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Copper,bromotris(triphenylphosphine)-, (T-4)-

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Name

Copper,bromotris(triphenylphosphine)-, (T-4)-

EINECS N/A
CAS No. 15709-74-7 Density N/A
PSA 40.77000 LogP 11.17750
Solubility N/A Melting Point 168-170 °C(lit.)
Formula C54H45BrCuP3 Boiling Point 360 °C at 760 mmHg
Molecular Weight 930.323 Flash Point 181.7 °C
Transport Information N/A Appearance N/A
Safety 22-24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 15709-74-7 (BROMOTRIS(TRIPHENYLPHOSPHINE)COPPER(I)&) Hazard Symbols N/A
Synonyms

Copper,bromotris(triphenylphosphine)- (7CI,8CI);Bromotris(triphenylphosphine)copper;Bromocopper-triphenylphosphane (1:3);Bromotris(triphenylphosphine)copper(I);

Article Data 17

Copper,bromotris(triphenylphosphine)-, (T-4)- Synthetic route

603-35-0

triphenylphosphine

7789-45-9

copper(ll) bromide

15709-74-7

bromotris(triphenylphosphine)copper(I)

Conditions
ConditionsYield
In methanol for 0.5h; Heating / reflux;93%
In methanol for 0.5h; Heating / reflux;93%
In acetone to soln. of bromide in hot acetone soln. of triphenylphosphine in hot acetone added dropwise with stirring, refluxed for several h; filterd, washed with petroleum ether, dried for several h in vac.; elem.anal.;34%
603-35-0

triphenylphosphine

7787-70-4

copper(I) bromide

15709-74-7

bromotris(triphenylphosphine)copper(I)

Conditions
ConditionsYield
In methanol for 4 - 5h;90%
In methanol for 0.5h; Reflux;87%
In acetonitrile at 80℃; for 1h; Inert atmosphere;71%
In chloroform pptd. from CHCl3 soln. of stoich. amt. of CuBr and PPh3; according to P.F. Barron et al., J. Chem. Soc., Dalton Trans., 1987, 1099 and G. Costa , E. Reisenhofer and L. Stefani, J. Inorg. Nucl. Chem., 1965, 27, 2581;
In methanol at 60℃; for 0.166667h;1.18 g

BrCu*(x)H2O

15709-74-7

bromotris(triphenylphosphine)copper(I)

Conditions
ConditionsYield
With triphenylphosphine In methanol copper halogenide : triphenylphosphine = 1 : 3.5, intensive stirring; suction and drying in high vac., elem. anal.;
7787-70-4

copper(I) bromide

15709-74-7

bromotris(triphenylphosphine)copper(I)

Conditions
ConditionsYield
With triphenylphosphine In dichloromethane stoich. amts. Ph3P and CuBr mixed in small volume methylene chloride; pentane, hexane or cyclohexane added until ppt. began to form, soln. cooled in ice bath and allowed to stand for a few minutes and filtered;
With triphenyl phosphine In chloroform Stoicheiometric quantities of reagents were refluxed for 2-4 h in CHCl3;; the hot soln. was filtered, slow cooling and evapd.;;
15709-74-7

bromotris(triphenylphosphine)copper(I)

2010-15-3

3-phenyl-2-thioxoimidazolidin-4-one

144886-62-4

{Cu(P(C6H5)3)2(C6H5NC(O)CH2NHC(S))Br}

Conditions
ConditionsYield
In benzene byproducts: triphenylphosphine; addn. of ligand to Cu complex soln.; refluxing, 2h; cooling; filtration; evapn. to half the volume; addn. of petroleum ether; standing, 2-3h; pptn.; centrifuging; washing (petroleum ether); drying (vac.); elem. anal.;96%
15709-74-7

bromotris(triphenylphosphine)copper(I)

63400-51-1

bis(1,2,4-triazol-1-yl)methane

166662-57-3

[(P(C6H5)3)Cu(C5H6N6)Br]

Conditions
ConditionsYield
In acetone byproducts: Ph3P; stirring; elem. anal.;96%
15093-54-6

N-phenyl-1-morpholinethiocarbamide

15709-74-7

bromotris(triphenylphosphine)copper(I)

144886-68-0

{Cu(P(C6H5)3)2(C6H5NHC(S)N(CH2CH2)2O)Br}

Conditions
ConditionsYield
In benzene byproducts: triphenylphosphine; addn. of ligand to Cu complex soln.; refluxing, 2h; cooling; filtration; evapn. to half the volume; addn. of petroleum ether; standing, 2-3h; pptn.; centrifuging; washing (petroleum ether); drying (vac.); elem. anal.;90%
66-71-7

1,10-Phenanthroline

15709-74-7

bromotris(triphenylphosphine)copper(I)

25753-84-8

(1,10-phenanthroline)(triphenylphosphine)CuBr

Conditions
ConditionsYield
In chloroform90%
In chloroform at 20℃; for 0.166667h;90%
In chloroform at 20℃; for 0.5h;75%
In chloroform at 20℃; for 0.5h;75%
In dichloromethane for 2h; Inert atmosphere;
253-72-5

1,6-naphthyridine

15709-74-7

bromotris(triphenylphosphine)copper(I)

[CuBr(PPh3)2(4-Mepy)]

Conditions
ConditionsYield
In chloroform89%
288-13-1

NH-pyrazole

15709-74-7

bromotris(triphenylphosphine)copper(I)

166662-78-8

[(P(C6H5)3)2Cu(C3H4N2)Br]

Conditions
ConditionsYield
In diethyl ether byproducts: Ph3P; stirring (6 h); elem. anal.;88%

Copper,bromotris(triphenylphosphine)-, (T-4)- Specification

The Copper,bromotris(triphenylphosphine)-, (T-4)- with CAS registry number of 15709-74-7 is also known as Bromotris(triphenylphosphine)copper(I). The systematic name is Bromocopper-triphenylphosphane (1:3). It belongs to product categories of Catalysis and Inorganic Chemistry; Chemical Synthesis; CopperMicro/Nanoelectronics; Electronic Chemicals; Others. In addition, the formula is C54H45BrCuP3 and the molecular weight is 930.31. During using it, do not breathe dust and avoid contact with skin and eyes. What's more, it should be sealed in cool, dry place away from oxides and air.

Physical properties about Copper,bromotris(triphenylphosphine)-, (T-4)- are: (1)ACD/LogP: 5.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.69; (4)ACD/LogD (pH 7.4): 5.69; (5)ACD/BCF (pH 5.5): 12427.96; (6)ACD/BCF (pH 7.4): 12427.96; (7)ACD/KOC (pH 5.5): 29672.91; (8)ACD/KOC (pH 7.4): 29672.91; (9)#Freely Rotating Bonds: 3; (10)Flash Point: 181.7 °C; (11)Enthalpy of Vaporization: 58.18 kJ/mol; (12)Boiling Point: 360 °C at 760 mmHg; (13)Vapour Pressure: 4.74E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: Br[Cu].c3c(P(c1ccccc1)c2ccccc2)cccc3.c1ccccc1P(c2ccccc2)c3ccccc3.c1ccccc1P(c2ccccc2)c3ccccc3
2. InChI: InChI=1/3C18H15P.BrH.Cu/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h3*1-15H;1H;/q;;;;+1/p-1
3. InChIKey: QXLPGKOIQZWUPL-REWHXWOFAV
4. Std. InChI: InChI=1S/3C18H15P.BrH.Cu/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h3*1-15H;1H;/q;;;;+1/p-1
5. Std. InChIKey: QXLPGKOIQZWUPL-UHFFFAOYSA-M

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