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10026-11-6

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10026-11-6 Usage

General Description

Zirconium tetrachloride is a chemical compound with the formula ZrCl4. It is a colorless, volatile liquid that is used as a precursor for the production of zirconium metal and other zirconium compounds. It is widely used in the production of ceramics, glass, and as a catalyst in organic synthesis. Zirconium tetrachloride is highly reactive and sensitive to air and moisture, and it can cause severe skin and eye irritation upon contact. It is also toxic if ingested or inhaled, and precautions should be taken when handling this chemical.

Check Digit Verification of cas no

The CAS Registry Mumber 10026-11-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,0,0,2 and 6 respectively; the second part has 2 digits, 1 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 10026-11:
(7*1)+(6*0)+(5*0)+(4*2)+(3*6)+(2*1)+(1*1)=36
36 % 10 = 6
So 10026-11-6 is a valid CAS Registry Number.
InChI:InChI=1/4ClH.2Zr/h4*1H;;/q;;;;2*+2/p-4

10026-11-6 Well-known Company Product Price

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  • Alfa Aesar

  • (L14891)  Zirconium(IV) chloride, 98%, cont. 1-2% hafnium(IV) chloride   

  • 10026-11-6

  • 50g

  • 203.0CNY

  • Detail
  • Alfa Aesar

  • (L14891)  Zirconium(IV) chloride, 98%, cont. 1-2% hafnium(IV) chloride   

  • 10026-11-6

  • 250g

  • 676.0CNY

  • Detail
  • Alfa Aesar

  • (12104)  Zirconium(IV) chloride, Reactor Grade, 99.5+% (metals basis)   

  • 10026-11-6

  • 10g

  • 246.0CNY

  • Detail
  • Alfa Aesar

  • (12104)  Zirconium(IV) chloride, Reactor Grade, 99.5+% (metals basis)   

  • 10026-11-6

  • 100g

  • 354.0CNY

  • Detail
  • Alfa Aesar

  • (12104)  Zirconium(IV) chloride, Reactor Grade, 99.5+% (metals basis)   

  • 10026-11-6

  • 500g

  • 1462.0CNY

  • Detail
  • Alfa Aesar

  • (12104)  Zirconium(IV) chloride, Reactor Grade, 99.5+% (metals basis)   

  • 10026-11-6

  • 2kg

  • 5117.0CNY

  • Detail
  • Aldrich

  • (647640)  Zirconium(IV)chloride  anhydrous, powder, 99.99% trace metals basis

  • 10026-11-6

  • 647640-5G

  • 1,125.54CNY

  • Detail
  • Aldrich

  • (647640)  Zirconium(IV)chloride  anhydrous, powder, 99.99% trace metals basis

  • 10026-11-6

  • 647640-25G

  • 4,042.35CNY

  • Detail
  • Aldrich

  • (357405)  Zirconium(IV)chloride  ≥99.9% trace metals basis

  • 10026-11-6

  • 357405-10G

  • 293.67CNY

  • Detail
  • Aldrich

  • (357405)  Zirconium(IV)chloride  ≥99.9% trace metals basis

  • 10026-11-6

  • 357405-100G

  • 2,633.67CNY

  • Detail
  • Aldrich

  • (221880)  Zirconium(IV)chloride  ≥99.5% trace metals basis

  • 10026-11-6

  • 221880-5G

  • 264.42CNY

  • Detail
  • Aldrich

  • (221880)  Zirconium(IV)chloride  ≥99.5% trace metals basis

  • 10026-11-6

  • 221880-100G

  • 414.18CNY

  • Detail

10026-11-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name zirconium tetrachloride

1.2 Other means of identification

Product number -
Other names Zirconium(IV) chloride

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:10026-11-6 SDS

10026-11-6Synthetic route

zirconium monocarbide

zirconium monocarbide

chlorine
7782-50-5

chlorine

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) byproducts: coal, SiCl4; half continuous process with vertical silica tube by passing of Cl2 from below and addition of ZrC from top; damping of overheating reaction by addition of ZrSiO4 or ZrSiO4/C; elimination of residue (coal with 4.3% Zr) in 24 h;; condensation in Ni-vessel at >80°C to separate SiCl4;;94.6%
In neat (no solvent) byproducts: coal, SiCl4; half continuous process with vertical silica tube by passing of Cl2 from below and addition of ZrC from top; damping of overheating reaction by addition of ZrSiO4 or ZrSiO4/C; elimination of residue (coal with 4.3% Zr) in 24 h;; condensation in Ni-vessel at >80°C to separate SiCl4;;94.6%
In neat (no solvent) formation starts at 250°C; main product at 300-400°C; end of chloration at red heat;; removal under exclusion of air, melting under CO2;;>99
tetrachloro-2,2'-bipyridylzirconium
17099-99-9

tetrachloro-2,2'-bipyridylzirconium

A

[2,2]bipyridinyl
366-18-7

[2,2]bipyridinyl

B

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating under N2 above 400 °C;
zirconium
7440-67-7

zirconium

chlorine
7782-50-5

chlorine

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
With char coal In neat (no solvent) briquetting with a tenfold excess of char coal; heating the dry briquets at 600-650°C in stream of dry Cl2;; condensation of ZrCl4 in spherical condenser;;
chlorinating metallic Zr with dry chlorine at 453-693 K;; sublimation in a stream of dry hydrogen; elem. anal.;;
With pyrographite In neat (no solvent) calcinating of a mixture of Zr and C under Cl2;;
thionyl chloride
7719-09-7

thionyl chloride

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating of calcinated ZrO2 at 200-250°C with 5-6fold amount of SOCl2;;
In neat (no solvent) heating at 400°C;;>99
In neat (no solvent) heating below 400°C and then increasing temp.;;
phosgene
75-44-5

phosgene

zirconium silicate

zirconium silicate

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) byproducts: SiO2; reaction at 1300°C;;
phosgene
75-44-5

phosgene

baddeleyite

baddeleyite

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating baddeleyite in a rotary furnace to 500-600°C, countercurrent of COCl2;; extraction by heating with lime;;
phosgene
75-44-5

phosgene

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating;;
In neat (no solvent) heating at 400°C in a very slow stream of COCl2;;
In neat (no solvent) heating at 600-700°C;; sublimation in a stream of N2;;
boron trichloride
10294-34-5

boron trichloride

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) byproducts: H3BO3; on heating;;
In neat (no solvent) heating 2 hours in vac. at 200°C; back reaction at higher temperatures;;
In neat (no solvent) heating in an evacuated tube at 200°C;;
In neat (no solvent) heating 2 hours in vac. at 200°C; back reaction at higher temperatures;;
zirconium(IV) sulfate

zirconium(IV) sulfate

barium(II) chloride

barium(II) chloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating at 300°C;;
aluminium trichloride
7446-70-0

aluminium trichloride

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating 2 hours in vac. at 250°C;;
In neat (no solvent) byproducts: Al2O3; heating of pur, at 1200°C calcinated ZrO2 with an excess of AlCl3 in vacuum at 250°C;;
In neat (no solvent) heating 2 hours in vac. at 250°C;;
disulfur dichloride
10025-67-9

disulfur dichloride

chlorine
7782-50-5

chlorine

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) reaction of dry ZrO2 in S2Cl2/Cl2;;>99
With sugar coal In neat (no solvent) heating of ZrO2/sugar coal in a quartz vessel at 1200°C in a stream of S2Cl2/Cl2;; sublimation in vacuum;;
In neat (no solvent) heating of ZrO2 at red heat and further increasing temperature;; sublimation in a dry stream of Cl2;;
With sugar coal In neat (no solvent) heating of ZrO2/sugar coal in a quartz vessel at 1200°C in a stream of S2Cl2/Cl2;; sublimation in vacuum;;
disulfur dichloride
10025-67-9

disulfur dichloride

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating for a longer period of time at softening point of glass;;
With chlorine In neat (no solvent) heating to red heat;;>99
In neat (no solvent) heating of calcinated ZrO2 and S2Cl2 to red heat;;
zirconium silicate

zirconium silicate

chlorine
7782-50-5

chlorine

A

tetrachlorosilane
10026-04-7, 53609-55-5

tetrachlorosilane

B

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
With hard coal In neat (no solvent) briquet of zircon sand,hard coal and a binder (sulfite waste liquor) at 800°C (free of water); passing mixture of Cl2 and O2 over at 800-1000°C;;
With pyrographite In neat (no solvent) briquet of zircon, charcoal and tar; passing Cl2 over; for example: at 800°C, 12 h, reaction of 89% of Zr;;
zirconium silicate

zirconium silicate

chlorine
7782-50-5

chlorine

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
With pyrographite In neat (no solvent) calcination of ZrSiO4 in presence of chlorine and C;;
tetrachlorosilane
10026-04-7, 53609-55-5

tetrachlorosilane

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating in a stream of gaseous SiCl4 in a porcelain tube; precipition of ZrCl4 in the condenser, Zr silicate is remaining in the tube;;
In neat (no solvent) heating 2 hours in vac. at 200°C; back reaction at higher temperatures;;
In neat (no solvent) heating 2 hours in vac. at 200°C; back reaction at higher temperatures;;
tetrachlorosilane
10026-04-7, 53609-55-5

tetrachlorosilane

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

B

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating in an evacuated tube at 200°C;;
tetrachloromethane
56-23-5

tetrachloromethane

chlorine
7782-50-5

chlorine

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) calcination of purified ZrO2 in CCl4/Cl2 at 550-600°C in a porcelain tube, covered with asbestos, in iron tube; precipitation of the product at the colder part of the tube;; sublimation of ZrCl4 in a slow stream of gas at 140°C;;
In neat (no solvent) beginning of the reaction at 300-350°C, heating up to 780°C and increasing of CCl4 concentration by heating of the CCl4 loaded Cl2 stream at 70-75°C;; sublimation of ZrCl4;;
In neat (no solvent) byproducts: FeCl3; at 450°C;; polluted with small amounts of FeCl3;;>99
tetrachloromethane
56-23-5

tetrachloromethane

zirconium(II) hydride

zirconium(II) hydride

A

zirconium chloride

zirconium chloride

B

hexachloroethane
67-72-1

hexachloroethane

C

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

D

pyrographite
7440-44-0

pyrographite

Conditions
ConditionsYield
In neat (no solvent) reaction of ZnH2 with CCl4 at 20-250°C; below the b.p. of CCl4 formation of ZrCl2 and C2Cl6, above the b.p. formation of ZrCl4 and C;;
tetrachloromethane
56-23-5

tetrachloromethane

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

A

phosgene
75-44-5

phosgene

B

oxygen
80937-33-3

oxygen

C

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) reaction at 1000K; mechanism discussed;; determination by IR;;
In neat (no solvent) reaction at 1000K; mechanism discussed;; determination by IR;;
tetrachloromethane
56-23-5

tetrachloromethane

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) passing vapor of CCl4 over ZrO2 below red heat;;
With chlorine In neat (no solvent) byproducts: C2Cl6; formation of ZrCl4 and considerable amounts of C2Cl6;;
With chlorine In neat (no solvent) heating;;
hydrogenchloride
7647-01-0

hydrogenchloride

zirconium silicide

zirconium silicide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) byproducts: FeCl2; heating reaction chamber to yellow heat, then addition of educts;; condensation of FeCl2 (from impurity) in first chamber at 300-500°C, then of ZrCl4 at 150°C or below in further chambers;;
zirconium(IV) fluoride
851363-60-5, 7783-64-4

zirconium(IV) fluoride

tin(ll) chloride

tin(ll) chloride

magnesium chloride
7786-30-3

magnesium chloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) dissolving 25 weight % MgCl2 in molten SnCl2; addn. of ZrF4; heating mixture to 540°C;; sublimation of ZrCl4 under He into a condenser;;
zirconium(IV) fluoride
851363-60-5, 7783-64-4

zirconium(IV) fluoride

magnesium chloride
7786-30-3

magnesium chloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) a dry mixture of ZrF4 and MgCl2 is heated 1-2 hours in a closed tube at 750°C;; sublimation of ZrCl4 under He into a condenser;;
phosphorus pentachloride
10026-13-8, 874483-75-7

phosphorus pentachloride

zirconium(IV) oxide
7440-67-7

zirconium(IV) oxide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) byproducts: POCl3; heating 8 hours in an evacuated tube at 190°C;; destillation in a stream of Cl2 and sublimation;;
hydrogenchloride
7647-01-0

hydrogenchloride

zirconium(III) sulfide

zirconium(III) sulfide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating at 280°C;;
In neat (no solvent) heating at 280°C;;
hydrogenchloride
7647-01-0

hydrogenchloride

zirconium sulfide

zirconium sulfide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating at 210°C;;
hydrogenchloride
7647-01-0

hydrogenchloride

zirconium monocarbide

zirconium monocarbide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) no chloration of SiO2 impurities;;
In neat (no solvent) byproducts: FeCl2; heating reaction chamber to yellow heat, then addition of educts;; condensation of FeCl2 (from impurity) in first chamber at 300-500°C, then of ZrCl4 at 150°C or below in further chambers;;
hydrogenchloride
7647-01-0

hydrogenchloride

zirconyl chloride

zirconyl chloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Conditions
ConditionsYield
In neat (no solvent) heating of ZrOCl2 in a stream of HCl at 100-150°C;;0%
In neat (no solvent) heating of ZrOCl2 in a stream of HCl at 100-150°C;;
zirconium
7440-67-7

zirconium

beryllium

beryllium

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

sodium chloride
7647-14-5

sodium chloride

Na4[(Zr6Be)Cl16]

Na4[(Zr6Be)Cl16]

Conditions
ConditionsYield
In neat (no solvent) stoichiometric mixture, sealed Ta container, 800-850°C;100%
In neat (no solvent) heating of stoich. amts. of reagents in a sealed Ta tube at 700-860°C for 2-3 weeks; identified by single crystal X-ray diffraction;>90
In neat (no solvent) mixt. of Zr, ZrCl4, NaCl and Be was sealed under Ar in Nb or Ta ampule; heated;
zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

hydrous zirconium oxide

hydrous zirconium oxide

Conditions
ConditionsYield
With sodium thiosulfate In water precipitation from Zr chloride solution at 70°C, large excess of thiosulfate;;100%
With Na2S2O3 In water precipitation from Zr chloride solution at 70°C, large excess of thiosulfate;;100%
With Alkaline In not given precipitation of Zr dioxide hydrate;;
zirconium
7440-67-7

zirconium

zirconium nitride chloride

zirconium nitride chloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Zr6Cl15N

Zr6Cl15N

Conditions
ConditionsYield
prepn. in a sealed tantal tube at 700 °C for 2 weeks;100%
In neat (no solvent) heating of stoich. amts. of reagents in a sealed Ta tube at 700-860°C for 2-3 weeks; identified by single crystal X-ray diffraction;>90
tetrahydrofuran
109-99-9

tetrahydrofuran

Zr(C6H5NCH2CH2CH2NC6H5)2
299410-39-2

Zr(C6H5NCH2CH2CH2NC6H5)2

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

Zr(PhN(CH2)3NPh)Cl2(THF)2
299410-33-6

Zr(PhN(CH2)3NPh)Cl2(THF)2

Conditions
ConditionsYield
In diethyl ether byproducts: LiCl; N2 atm.; THF and diethyl ether were added by vac. transfer at -78°C to the mixt. of complex and ZrCl4, the mixt. was warmed to 0°Cin an ice bath, stirred overnight, allowed to warm to room temp.; volatiles were removed under vac. at 23°C; elem. anal.;100%
[Zr(bis(2-hydroxy-2-methylpropyl)sulfide(-2H))2]
869289-28-1

[Zr(bis(2-hydroxy-2-methylpropyl)sulfide(-2H))2]

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

[ZrCl2(bis(2-hydroxy-2-methylpropyl)sulfide(-2H))]
869289-31-6

[ZrCl2(bis(2-hydroxy-2-methylpropyl)sulfide(-2H))]

Conditions
ConditionsYield
In toluene (Ar); Schlenk technique; soln. of Zr-S complex in toluene was added to suspn. of ZrCl4 in toluene at -30°C; mixt. was stirred for 12 h while slowly warmed to room temp.; volatiles removed (vac.);100%
[(C6H5CH2N(CH2C(CH3)2O)2)2Zr]2

[(C6H5CH2N(CH2C(CH3)2O)2)2Zr]2

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

[(C6H5CH2N(CH2C(CH3)2O)2)ZrCl2]
869882-32-6

[(C6H5CH2N(CH2C(CH3)2O)2)ZrCl2]

Conditions
ConditionsYield
In toluene (Ar); Schlenk technique; soln. of Zr complex in toluene and soln. of ZrCl4 in toluene were cooled at -30°C and rapidly mixed; mixt. was stirred for 24 h at room temp.; volatiles removed (vac.); elem. anal.;100%
Li(1+)*C13H17BCH3(1-)=Li(C13H17BCH3)

Li(1+)*C13H17BCH3(1-)=Li(C13H17BCH3)

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

ZrCl2(C13H17BCH3)2

ZrCl2(C13H17BCH3)2

Conditions
ConditionsYield
In diethyl ether under N2; addn. of Li compd. in Et2O to suspn. of ZrCl4 in Et2O cooled to -60°C, warming to room temp. and stirring for one week; filtration through kieselguhr, evapn. in vacuo;100%
tetrahydrofuran
109-99-9

tetrahydrofuran

C28H32N2O2

C28H32N2O2

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

(x)C4H8O*C28H30N2O2(2-)*2Cl(1-)*Zr(4+)

(x)C4H8O*C28H30N2O2(2-)*2Cl(1-)*Zr(4+)

Conditions
ConditionsYield
Stage #1: tetrahydrofuran; C28H32N2O2 With n-butyllithium In hexane at -78 - 20℃; for 2.16667h;
Stage #2: zirconium(IV) chloride In hexane at -78 - 20℃; for 18.3333h;
100%
C85H104F2N2O4

C85H104F2N2O4

methylmagnesium bromide
75-16-1

methylmagnesium bromide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

C87H108F2N2O4Zr

C87H108F2N2O4Zr

Conditions
ConditionsYield
In toluene at -30 - 20℃; for 3.08333h;100%
deferoxamine
70-51-9

deferoxamine

water
7732-18-5

water

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

zirconium(IV) desferrioxamine(OH)2

zirconium(IV) desferrioxamine(OH)2

Conditions
ConditionsYield
at 20℃; for 24h;100%
acetylhydroxamic acid
546-88-3

acetylhydroxamic acid

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

[Zr(acetohydroxamate acid)4]

[Zr(acetohydroxamate acid)4]

Conditions
ConditionsYield
In methanol at 75℃; for 15h; Inert atmosphere; Schlenk technique;100%
selenium
7782-49-2

selenium

selenium tetrachloride
10026-03-6

selenium tetrachloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

cyclo-tetraselenium(2+) hexachlorozirconate(2-)
166822-45-3

cyclo-tetraselenium(2+) hexachlorozirconate(2-)

Conditions
ConditionsYield
In neat (no solvent) (argon); evacuated sealed glass ampoule (furnace with temperature gradient 135 to 120°C, 2 d);99%
(R)-(+)-2,2'-bis(bicyclo[5.3.0]-deca-1(10),7(8)-dien-9-yl)-1,1'-binaphthyl

(R)-(+)-2,2'-bis(bicyclo[5.3.0]-deca-1(10),7(8)-dien-9-yl)-1,1'-binaphthyl

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

ansa-[2,2'-bis(bicyclo[5.3.0]-deca-1(10),7(8)-dien-9-yl)-1,1'-binaphthyl]-dichlorozirconium

ansa-[2,2'-bis(bicyclo[5.3.0]-deca-1(10),7(8)-dien-9-yl)-1,1'-binaphthyl]-dichlorozirconium

Conditions
ConditionsYield
With n-BuLi In diethyl ether; n-heptane byproducts: LiCl; Ar-atmosphere; slow addn. of excess BuLi (in heptane) to binaphthyl derivative (in Et2O) at 0°C, stirring (room temp., 2 h), addn. of slight excess ZrCl4, stirring (room temp., 12 h); solvent removal, dissoln. in C6H6, filtration off of LiCl, washing (C6H6), solvent removal;99%
tellurium

tellurium

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

tellurium tetrachloride
10026-07-0

tellurium tetrachloride

catena-hexatellurium(2+) hexachlorozirconate(IV)

catena-hexatellurium(2+) hexachlorozirconate(IV)

Conditions
ConditionsYield
In neat (no solvent, solid phase) Te, TeCl4 and ZrCl4 filled in glass ampoule under Ar, ampoule evacuated,sealed and heated in horizontal tube furnace to 220°C, ampoule p laced assymetrically, so temp. gradient of 20°C from the hot charged end to empty, heated for 3 wk; crystals formed in colder part of ampoule;99%
2-{ [5-(2-(trifluoromethyl)phenyl) furan-2-yl]methyleneamino}phenol
1092795-53-3

2-{ [5-(2-(trifluoromethyl)phenyl) furan-2-yl]methyleneamino}phenol

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

C18H11Cl3F3NO2Zr
1092795-65-7

C18H11Cl3F3NO2Zr

Conditions
ConditionsYield
Stage #1: 2-{ [5-(2-(trifluoromethyl)phenyl) furan-2-yl]methyleneamino}phenol With sodium hydride In tetrahydrofuran at -20℃; for 2h;
Stage #2: zirconium(IV) chloride In tetrahydrofuran at 20℃;
99%
tetrahydrofuran
109-99-9

tetrahydrofuran

C35H38N2O2

C35H38N2O2

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

(x)C4H8O*C35H36N2O2(2-)*2Cl(1-)*Zr(4+)

(x)C4H8O*C35H36N2O2(2-)*2Cl(1-)*Zr(4+)

Conditions
ConditionsYield
Stage #1: tetrahydrofuran; C35H38N2O2 With n-butyllithium In hexane at -78 - 20℃; for 2.16667h;
Stage #2: zirconium(IV) chloride In hexane at -78 - 20℃; for 18.3333h;
99%
C42H42O4Si2

C42H42O4Si2

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

C42H40Cl2O4Si2Zr

C42H40Cl2O4Si2Zr

Conditions
ConditionsYield
Stage #1: C42H42O4Si2 With n-butyllithium In tetrahydrofuran; hexane; toluene at -78 - 60℃; for 1.33333h; Inert atmosphere;
Stage #2: zirconium(IV) chloride In tetrahydrofuran; hexane; toluene at -78 - 20℃; Inert atmosphere;
99%
2-hydroxyterephthalic acid
636-94-2

2-hydroxyterephthalic acid

water
7732-18-5

water

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

acetic acid
64-19-7

acetic acid

5.6C8H4O5(2-)*4HO(1-)*4O(2-)*6Zr(4+)*0.8C2H3O2(1-)

5.6C8H4O5(2-)*4HO(1-)*4O(2-)*6Zr(4+)*0.8C2H3O2(1-)

Conditions
ConditionsYield
In N,N-dimethyl-formamide at 120℃; for 24h; Reagent/catalyst;99%
bis(n-butylcyclopentadienyl)zirconium dichloride
73364-10-0

bis(n-butylcyclopentadienyl)zirconium dichloride

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

(n-butylcyclopentadienyl)zirconium chloride

(n-butylcyclopentadienyl)zirconium chloride

Conditions
ConditionsYield
In toluene at 120℃; for 16h; Schlenk technique;99%
N-methylcyclohexylamine
100-60-7

N-methylcyclohexylamine

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

tetrakis(cyclohexylmethylamide)zirconium
610786-42-0

tetrakis(cyclohexylmethylamide)zirconium

Conditions
ConditionsYield
With Li-n-Bu In hexane; toluene in oxygen and moisture free atmosphere; soln. of ligand in toluene addeddropwise to soln. of Li-n-Bu in hexane; stirred at room temp. for 2.5 h ; ZrCl4 added gradually for 30 min; stirred for 18 h; filtered; filtrate reduced to oil under reduced pressure; elem. anal.;98.7%
15-crown-5
33100-27-5

15-crown-5

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

sodium fluoride

sodium fluoride

{Na-15-crown-5}2-cis-{ZrF2Cl4}

{Na-15-crown-5}2-cis-{ZrF2Cl4}

Conditions
ConditionsYield
In acetonitrile soln. of ZrCl4 and 15-crown-5 prepared under cooling; addn. of NaF; stirred for 12 h at 25°C; filtration; solvent removed until beginning of crystn.; cooled down to 5°C; crystn.; filtration; washed (cold acetonitrile); dried under vac.; elem. anal.; IR;98.3%
1,4-dithiabutanediyl-2,2'-bis(6-tert-butyl-4-methoxyphenol)

1,4-dithiabutanediyl-2,2'-bis(6-tert-butyl-4-methoxyphenol)

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

dichloro{1,4-dithiabutanediyl-2,2'-bis(6-tert-butyl-4-methoxyphenoxy)}zirconium

dichloro{1,4-dithiabutanediyl-2,2'-bis(6-tert-butyl-4-methoxyphenoxy)}zirconium

Conditions
ConditionsYield
In toluene at -30 - 20℃;98%
zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

magnesium
7439-95-4

magnesium

zirconium
7440-67-7

zirconium

Conditions
ConditionsYield
In neat (no solvent) byproducts: MgCl2; heating at 900-1100°C;;98%
zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

zirconium
7440-67-7

zirconium

Conditions
ConditionsYield
With zinc In melt Electrolysis; melting electrolysis, Zn-electrode, addition of alkalichloride;; evaporation of Zn in vacuum at 700-800°C;;98%
With zinc In melt Electrolysis; melting electrolysis, Zn-electrode, addition of alkalichloride;; evaporation of Zn in vacuum at 700-800°C;;98%
With magnesium; sodium chloride In melt heating in an iron crucible, decanting of salt melt, addition of water and HCl to Zr residue after cooling down;; impured;;88%
pentamethylcyclopentadienyltrimethylsilane
136990-69-7

pentamethylcyclopentadienyltrimethylsilane

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

A

chloro-trimethyl-silane
75-77-4

chloro-trimethyl-silane

B

pentamethylcyclopentadienylzirconium(IV) trichloride

pentamethylcyclopentadienylzirconium(IV) trichloride

Conditions
ConditionsYield
In n-heptane Addn. of C5(CH3)5Si(CH3)3 to suspension of ZrCl4 in heptane (N2), slowly warming (60 °C), stirring (4 h), cooling.; Filtration, washed (hexane), dried (vacuum), elem. anal.;A n/a
B 98%
zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

1-methyl-2-(trimethylstannyl)-1,2-dihydroborinine
186891-73-6

1-methyl-2-(trimethylstannyl)-1,2-dihydroborinine

trichloro(1-methylboratabenzene)zirconium
193680-94-3

trichloro(1-methylboratabenzene)zirconium

Conditions
ConditionsYield
In hexane N2-atmosphere; stirring (20°C, 1 h); washing (hexane), drying (vac.);98%
methanol
67-56-1

methanol

1,2-bis(3,5-di-tert-butyl-2-hydroxyphenyl)oxamide
36931-29-0

1,2-bis(3,5-di-tert-butyl-2-hydroxyphenyl)oxamide

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

sodium hydroxide
1310-73-2

sodium hydroxide

dimeric (sodium)-[(μ-Cl)-bis[(3,5-di-tert-butyl-2-oxophenyl)oxamido-bis(dichloride zirconium(IV))]]*MeOH

dimeric (sodium)-[(μ-Cl)-bis[(3,5-di-tert-butyl-2-oxophenyl)oxamido-bis(dichloride zirconium(IV))]]*MeOH

Conditions
ConditionsYield
In methanol; water MeOH soln. of oxamide and 1 M soln. of 2 equiv. of NaOH soln. were mixedwith 2 equiv. of ZrCl4 at room temp.; soln. was evapd., elem. anal.;98%
[dimethyloctylsilyl]cyclopentadiene
850146-37-1

[dimethyloctylsilyl]cyclopentadiene

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

bis[(dimethyloctylsilyl)cyclopentadienyl]zirconium dichloride
850146-29-1

bis[(dimethyloctylsilyl)cyclopentadienyl]zirconium dichloride

Conditions
ConditionsYield
With n-BuLi In tetrahydrofuran; diethyl ether; hexane (N2); Schlenk technique; Si compd. added to stirred soln. of BuLi in C6H14/Et2O at -78°C; stirred (room temp., 3 h); solvent removed (vac.); dissolved in THF (-78°C); added to ZrCl4/THF at 0°C over 0.5 h; stirred (48 h, room temp.); volatiles removed (vac.); extd. (pentane); filtrate concd. (vac.); elem.anal.;98%
4,4'-bis(P-((S,S)-[2,6-bis(4'-isopropyl-2'-oxazolinyl)phenyl]gold(I))(diphenylphosphino))biphenyl*(benzene)

4,4'-bis(P-((S,S)-[2,6-bis(4'-isopropyl-2'-oxazolinyl)phenyl]gold(I))(diphenylphosphino))biphenyl*(benzene)

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

benzene
71-43-2

benzene

A

4,4'-bis[P-(chlorogold(I))diphenylphosphino]biphenyl
528522-58-9

4,4'-bis[P-(chlorogold(I))diphenylphosphino]biphenyl

B

(S,S)-[2,6-bis(4'-isopropyl-2'-oxazolinyl)phenyl]zirconium(IV) trichloride dimer*2(benzene)

(S,S)-[2,6-bis(4'-isopropyl-2'-oxazolinyl)phenyl]zirconium(IV) trichloride dimer*2(benzene)

Conditions
ConditionsYield
In tetrahydrofuran under N2; soln. of Au complex in THF added to solid ZrCl4; stirred at room temp. for 16 h; volatiles removed in vac.; extd. with benzene; centrifuged; ppt. flushedwith benzene; stirred overnight; supernatant sepd. by centrifugation; c ombined benzene extracts concd. in vac.; crystd. from benzene-hexane; elem. anal.;A 98%
B 82%
tetrahydrofuran
109-99-9

tetrahydrofuran

1,9-bis(3,5-di-tert-butyl-2-hydroxyphenyl)-5-phenyldipyrrin
1312816-22-0

1,9-bis(3,5-di-tert-butyl-2-hydroxyphenyl)-5-phenyldipyrrin

zirconium(IV) chloride
10026-11-6

zirconium(IV) chloride

[(1,9-bis(3,5-di-tert-butyl-2-hydroxyphenyl)-5-phenyldipyrrin(-3H))ZrCl(tetrahydrofuran)]
1312887-73-2

[(1,9-bis(3,5-di-tert-butyl-2-hydroxyphenyl)-5-phenyldipyrrin(-3H))ZrCl(tetrahydrofuran)]

Conditions
ConditionsYield
With NaH In tetrahydrofuran 1,9-bis(2-hydroxyphenyl)dipyrrin deriv. treated with NaH in THF, treatment with ZrCl4;98%

10026-11-6Relevant articles and documents

Synthesis of BaZrS3 in the presence of excess sulfur

Wang, Yarong,Sato, Nobuaki,Yamada, Kohta,Fujino, Takeo

, p. 214 - 223 (2000)

Synthetic reaction of barium zirconium sulfide, BaZrS3, was studied in a large excess amount of sulfur melt at temperatures of 623-723 K and in the presence of a small amount of excess sulfur at temperatures of 623-823 K, respectively. The results showed that BaZrS3 was formed with high yields by heating at temperatures ranging from 723 to 873 K, if a proper amount of excess sulfur and 10 mole% of BaCl2 were added in the starting materials. The compound could be obtained in almost a single phase with only 2-3 mole% ZrO2 impurity after the 8 min water treatment of the products obtained at 873 K. The modified method studied in this paper, i.e. reaction in the medium temperature range of 723-873 K, was shown to be applicable for synthesizing the mixed sulfides of some kinds including BaZrS3.

Zirconium tetrachloride revisited

Borjas Nevarez, Rosendo,Balasekaran, Samundeeswari Mariappan,Kim, Eunja,Weck, Philippe,Poineau, Frederic

, p. 307 - 311 (2018)

Zirconium tetrachloride, ZrCl 4, is a strategic material with wide-ranging applications. Until now, only one crystallographic study on ZrCl 4 has been reported [Krebs (1970). Z. Anorg. Allg. Chem. 378, 263-272] and that was more than 40 years ago. The compound used for the previous determination was prepared from ZrO 2 and Cl 2 -CCl 4, and single-crystal X-ray diffraction (SCXRD) studies on ZrCl 4 obtained from Zr metal have not yet been reported. In this context, we prepared ZrCl 4 from the reaction of Zr metal and Cl 2 gas in a sealed tube and investigated its structure at 100, 150, 200, 250, and 300 K. At 300 K, the SCXRD analysis indicates that ZrCl 4 crystallizes in the orthorhombic space group Pca2 1 [a = 6.262 (9), b = 7.402 (11), c = 12.039 (17) ?, and V = 558.0 (14) ? 3 ] and consists of infinite zigzag chains of edge-sharing ZrCl 6 octahedra. This chain motif is similar to that observed previously in ZrCl 4, but the structural parameters and space group differ. In the temperature range 100-300 K, no phase transformation was identified, while elongation of intra-chain Zr?Zr [3.950 (1) ? at 100 K and 3.968 (5) ? at 300 K] and inter-chain Cl?Cl [3.630 (3) ? at 100 K and 3.687 (9) ? at 300 K] distances occurred.

Ziebarth, Robin P.,Corbett, John D.

, p. 56 - 67 (1989)

Lister, M. W.,Sutton, L. E.

, p. 393 - 406 (1941)

Venable, F. P.

, p. 469 - 475 (1894)

Chemical vapor transport of layer structured crystal β-ZrNCl

Ohashi, M.,Yamanaka, S.,Hattori, M.

, p. 342 - 347 (1988)

A layer structured compounds β-ZrNCl is transported to a higher temperature zone with the aid of ammonium chloride as the transporting agent in the temperature range of 823-1173 K. The transport mechanism can be explained by the formation of a volatile compound (NH4)2ZrCl6. The measurements of the vapor pressure and the mass spectrum revealed that (NH4)2ZrCl6 decomposed congruently according to the equation presented. The enthalpy change for the decomposition was determined to be 533 kJ/mol. By combining the above two equations, a simplified transport equation is derived.

Razuvaev, G. A.,Vyshinskaya, L. I.,Vasil'eva, G. A.,Malysheva, A. V.,Mar'in, V. P.

, p. L285 - L288 (1980)

Thermodynamic properties of zirconium chlorides. I. The standard molar enthalpy of formation, the low-temperature heat capacity, the standard molar entropy, and the standard molar Gibbs energy of formation of zirconium trichloride

Efimov, M. E.,Prokopenko, I. V.,Tsirelnikov, V. I.,Troyanov, S. I.,Medvedev, V. A.,et al.

, p. 353 - 358 (1987)

The enthalpies of the reaaction of ZrCl3(cr) and of ZrCl4(cr) with 3 mol * dm-3 HCl solution were measured in a 0.1 dm3 reaction vessel of the isoperibol calorimeter LKB-8700.The enthalpy change of the resulting reaction: ZrCl3(cr) + HCl(sln, 17.06H2O) = ZrCl4(cr) + 0.5H2(g), was found to be ΔrHm0(298.15 K) = -(62.6+/-2.7) kJ * mol-1 which leads to ΔfHm0(ZrCl3, cr, 298.15 K) = -(753.9+/-3.0) kJ * mol-1.Heat-capacity measurements between 7 and 312 K were performed on a pure sample of ZrCl3(cr).The following standard molar thermodynamic quantities are reported at T0 = 298.15 K: the heat capacity: Cp,m0(T0) = (92.871+/-0.089) J * K-1 * mol-1; the entropy: Sm0(T0) = (137.50+/-0.28) J * K-1 * mol-1; the enthalpy increment: m0(T0)-Hm0(0)> = (19239+/-29) J * mol-1; and the Gibbs energy of formation: ΔfGm0(T0) = -(685.0+/-1.5) kJ * mol-1.

Titanium, zirconium, and hafnium metal atom reactions with CF4, CCl4, and CF2Cl2: A matrix isolation spectroscopic and DFT investigation of triplet XC÷MX3 complexes

Lyon, Jonathan T.,Andrews, Lester

, p. 2519 - 2527 (2008/10/09)

Laser-ablated group 4 transition metal atoms react with CF4 to form triplet state electron-deficient FC÷MFa methylidyne complexes, which are identified by their infrared spectra and comparison to density functional vibrational frequency calculations of stable possible products. Of particular interest in these complexes are the strong C-X bonds and carbon-metal n bonding. The two unpaired electrons on carbon are drawn to the electron-deficient transition metal center, forming a partially filled triple bond, which is approximately equal in length to a classical C=M double bond. Reactions with carbon tetrachloride form the analogous ClC÷MCl3 complexes, whereas reactions with CF2Cl2 form a mixture of FC÷MFCl2 and ClC÷MF2Cl species. The FC÷MFCl2 complexes involving more α-Cl transfer are favored in the reaction of excited metal atoms during sample deposition, but UV irradiation photoisomerizes FC÷MFCl2 to the lower energy ClC÷MF2Cl complexes with more α-F transfer to the metal center.

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