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677-21-4

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677-21-4 Usage

Chemical Properties

Colorless transparent liquefied gas.

Uses

Trifluoropropene is used in the production of fluorosilicone rubber and fluorine-containing silicones used in hydraulic fluids.

Preparation

Trifluoropropene is prepared by fluorination and dehalogenation of 1,1,3,3-tetrachloropropane.

Check Digit Verification of cas no

The CAS Registry Mumber 677-21-4 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 6,7 and 7 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 677-21:
(5*6)+(4*7)+(3*7)+(2*2)+(1*1)=84
84 % 10 = 4
So 677-21-4 is a valid CAS Registry Number.

677-21-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 3,3,3-trifluoroprop-1-ene

1.2 Other means of identification

Product number -
Other names 3,3,3-Trifluoropropene

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Intermediates
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:677-21-4 SDS

677-21-4Synthetic route

1,1,1,3-tetrachloropropane
1070-78-6

1,1,1,3-tetrachloropropane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With hydrogen fluoride at 225 - 250℃;90%
With hydrogen fluoride; activated by HF amorphous Zn/chromia catalyst at 200℃; under 760.051 Torr; for 15h; Inert atmosphere;100 %Chromat.
With hydrogen fluoride; activated by HF amorphous Zn/chromia catalyst at 200℃; under 760.051 Torr; for 15h; Inert atmosphere;100 %Chromat.
1,1,1-trifluoropropan-2-yl 1,1,2,2,3,3 ,4,4,4-nonafluorobutane-1-sulfonate
118334-94-4

1,1,1-trifluoropropan-2-yl 1,1,2,2,3,3 ,4,4,4-nonafluorobutane-1-sulfonate

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With potassium fluoride; 18-crown-6 ether In acetylacetone at 100 - 140℃;80%
3,3,3-Trifluoropropanol
2240-88-2

3,3,3-Trifluoropropanol

A

1,1,1,3-tetrafluoropropane
460-36-6

1,1,1,3-tetrafluoropropane

B

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With cesium fluoride; sulphur hexafluoride; 1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene In dichloromethane-d2 at 20℃; for 0.5h; Inert atmosphere; UV-irradiation; Overall yield = 38%;A 79%
B n/a
Vinyl bromide
593-60-2

Vinyl bromide

metyhyl chlorodifluoroacetate
1514-87-0

metyhyl chlorodifluoroacetate

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With potassium fluoride; copper(l) iodide In N,N-dimethyl-formamide at 100℃; for 10h;56%
With potassium fluoride; copper(l) iodide In N,N-dimethyl-formamide at 100 - 120℃; for 7h;
2-bromo-3,3,3-trifluoropropene
1514-82-5

2-bromo-3,3,3-trifluoropropene

A

1,1-difluoroallene
430-64-8

1,1-difluoroallene

B

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
Stage #1: 2-bromo-3,3,3-trifluoropropene With n-butyllithium In diethyl ether at -78℃; for 0.25h;
Stage #2: With methanol In diethyl ether at -78℃;
A 54%
B 20%
Stage #1: 2-bromo-3,3,3-trifluoropropene With sec.-butyllithium In diethyl ether; cyclohexane at -105℃; for 0.25h;
Stage #2: With methanol In diethyl ether; cyclohexane at -105℃;
A 26 % Spectr.
B 60 % Spectr.
Stage #1: 2-bromo-3,3,3-trifluoropropene With n-butyllithium In diethyl ether; cyclohexane at -78℃; for 0.25h;
Stage #2: With methanol In diethyl ether; cyclohexane at -78℃;
A 54 % Spectr.
B 20 % Spectr.
1,1,1,3,3,3-hexafluoro-2-methyl-propane
382-09-2

1,1,1,3,3,3-hexafluoro-2-methyl-propane

A

trifluoromethan
75-46-7

trifluoromethan

B

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

C

1,1,3,3,3-pentafluoro-2-methyl-1-propene
2253-00-1

1,1,3,3,3-pentafluoro-2-methyl-1-propene

Conditions
ConditionsYield
With nickel at 660℃; Product distribution / selectivity;A 43.5%
B 24.5 %Chromat.
C 0%
1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With potassium hydroxide
3-chloro-1,1,1-trifluoropropane
460-35-5

3-chloro-1,1,1-trifluoropropane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With dichloromethane; alkali hydroxide
With alkaline solution
durch HCl-Abspaltung;
3-bromo-1,1,1-trifluoropropane
460-32-2

3-bromo-1,1,1-trifluoropropane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With potassium hydroxide
With potassium hydroxide
3,3,3-trichloro-1-propene
2233-00-3

3,3,3-trichloro-1-propene

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With antimony dichloride trifluoride; antimony(III) fluoride; 1,2-dichloro-ethane
acetic acid-(β,β,β-trifluoro-isopropyl ester)
400-37-3

acetic acid-(β,β,β-trifluoro-isopropyl ester)

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
at 490℃;
acrylic acid
79-10-7

acrylic acid

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
With sulfur tetrafluoride
With sulfur tetrafluoride at 130℃; for 8h;
chloro-(2,2,2-trifluoro-1-hydroxymethyl-ethyl)-mercury
815-37-2

chloro-(2,2,2-trifluoro-1-hydroxymethyl-ethyl)-mercury

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Conditions
ConditionsYield
(pyrolysis);
propionic acid
802294-64-0

propionic acid

trifluoroacetic acid
76-05-1

trifluoroacetic acid

A

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

B

1,1,1,4,4,4-hexafluorobutane
407-59-0

1,1,1,4,4,4-hexafluorobutane

C

1,1,1,4,4,4-hexafluoro-2-(trifluoromethyl)butane
367-53-3

1,1,1,4,4,4-hexafluoro-2-(trifluoromethyl)butane

D

1,1,1,6,6,6-hexafluoro-3-trifluoromethyl-hexane
40932-59-0

1,1,1,6,6,6-hexafluoro-3-trifluoromethyl-hexane

Conditions
ConditionsYield
With sodium proprionate In water (electrolysis);
1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

perfluorobis(methyl)propylmethyl carbanion
80318-41-8

perfluorobis(methyl)propylmethyl carbanion

A

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

B

1,1,1,2,2,3,3,5,5,5-decafluoro-4-trifluoromethyl-pentane
30320-28-6

1,1,1,2,2,3,3,5,5,5-decafluoro-4-trifluoromethyl-pentane

1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

A

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

B

perfluoro-2-methyl-2-pentene
359-72-8

perfluoro-2-methyl-2-pentene

C

1,1,1,2,2,3,3,5,5,5-decafluoro-4-trifluoromethyl-pentane
30320-28-6

1,1,1,2,2,3,3,5,5,5-decafluoro-4-trifluoromethyl-pentane

Conditions
ConditionsYield
With perfluoro-4-methyl-2-pentene; cesium fluoride In N,N-dimethyl-formamide at 60℃; for 18h;
ethene
74-85-1

ethene

iodotrifluoromethane
2314-97-8

iodotrifluoromethane

A

1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

B

vinyliodide
593-66-8

vinyliodide

C

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

D

acetylene
74-86-2

acetylene

Conditions
ConditionsYield
under 820 Torr; Quantum yield; Irradiation; CO2 laser induced telomerization;
perfluoro-4-methyl-2-pentene
2070-70-4

perfluoro-4-methyl-2-pentene

A

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

B

perfluoro-2-methyl-2-pentene
359-72-8

perfluoro-2-methyl-2-pentene

C

1,1,1,2,2,3,3,5,5,5-decafluoro-4-trifluoromethyl-pentane
30320-28-6

1,1,1,2,2,3,3,5,5,5-decafluoro-4-trifluoromethyl-pentane

Conditions
ConditionsYield
With 1,1,1-trifluoro-3-iodopropane; cesium fluoride In N,N-dimethyl-formamide at 60℃; for 18h;
C10H10F3

C10H10F3

A

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

B

benzyl radical
2154-56-5

benzyl radical

Conditions
ConditionsYield
Rate constant;
ethene
74-85-1

ethene

trifluoroacetic anhydride
407-25-0

trifluoroacetic anhydride

A

1,1,1-trifluoropropane
421-07-8

1,1,1-trifluoropropane

B

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

C

1,1,1,6,6,6-hexafluorohexane
3834-39-7

1,1,1,6,6,6-hexafluorohexane

D

1,1,1,8,8,8-Hexafluoro-octane
4248-82-2

1,1,1,8,8,8-Hexafluoro-octane

Conditions
ConditionsYield
at 26.9℃; under 50.3 Torr; Irradiation; Further byproducts given;A 9.5 % Chromat.
B 9.8 % Chromat.
C 71.0 % Chromat.
D 7.8 % Chromat.
at 26.9℃; under 50.3 Torr; Irradiation; Further byproducts given;A 8.2 % Chromat.
B 8.0 % Chromat.
C 83.0 % Chromat.
D 0.4 % Chromat.
1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

A

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

B

1,1,1,6,6,6-hexafluorohexane
3834-39-7

1,1,1,6,6,6-hexafluorohexane

Conditions
ConditionsYield
With silver at -73.1 - 76.9℃; Thermodynamic data; activation energy: E(a);
trifluoromethyl radical
2264-21-3

trifluoromethyl radical

3,3,3-trifluoro-propyl
2980-46-3

3,3,3-trifluoro-propyl

A

1,1,1-trifluoropropane
421-07-8

1,1,1-trifluoropropane

B

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

C

1,1,1,4,4,4-hexafluorobutane
407-59-0

1,1,1,4,4,4-hexafluorobutane

D

1,1,1,6,6,6-hexafluorohexane
3834-39-7

1,1,1,6,6,6-hexafluorohexane

Conditions
ConditionsYield
disproportionation-combination rate constant ratio for gas-phase; comparison of substituent effects;
3,3,3-trifluoro-propyl
2980-46-3

3,3,3-trifluoro-propyl

A

1,1,1-trifluoropropane
421-07-8

1,1,1-trifluoropropane

B

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

C

1,1,1,4,4,4-hexafluorobutane
407-59-0

1,1,1,4,4,4-hexafluorobutane

D

1,1,1,6,6,6-hexafluorohexane
3834-39-7

1,1,1,6,6,6-hexafluorohexane

Conditions
ConditionsYield
disproportionation-combination rate constant ratio for gas-phase; comparison of substituent effects;
acrylic acid
79-10-7

acrylic acid

sulfur tetrafluoride

sulfur tetrafluoride

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

3,3,3-trichloro-1-propene
2233-00-3

3,3,3-trichloro-1-propene

antimony(III) fluoride
7783-56-4

antimony(III) fluoride

1,2-dichloro-ethane
107-06-2

1,2-dichloro-ethane

antimony dichloride trifluoride

antimony dichloride trifluoride

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

ethanolic KOH-solution

ethanolic KOH-solution

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

3-chloro-1,1,1-trifluoropropane
460-35-5

3-chloro-1,1,1-trifluoropropane

ethanolic KOH-solution

ethanolic KOH-solution

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

3-chloro-1,1,1-trifluoropropane
460-35-5

3-chloro-1,1,1-trifluoropropane

KOH-solution

KOH-solution

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,1,1-trifluoro-3-iodopropane
460-37-7

1,1,1-trifluoro-3-iodopropane

potassium hydroxide

potassium hydroxide

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

ethyl chlorooximidoacetate
95080-93-6

ethyl chlorooximidoacetate

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

ethyl 5-(trifluoromethyl)-4,5-dihydroisoxazole-3-carboxylate
1432511-65-3

ethyl 5-(trifluoromethyl)-4,5-dihydroisoxazole-3-carboxylate

Conditions
ConditionsYield
With sodium hydrogencarbonate In ethyl acetate at -65 - 25℃; for 72h; Inert atmosphere;100%
With sodium hydrogencarbonate In ethyl acetate at -78 - 20℃; for 60h;3.2 g
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

(rac)-3,3,3-trifluoro-1,2-propanediol
431-39-0

(rac)-3,3,3-trifluoro-1,2-propanediol

Conditions
ConditionsYield
With pyridine; sodium metabisulfite; osmium(VIII) oxide multistep reaction; stoichiometric and catalytic oxidation of electron-poor olefins with OsO4; other fluoroolefins;99%
With pyridine; sodium metabisulfite; osmium(VIII) oxide 1) n-hexane, r.t., 1 h, 2) H2O, pyridine, 24 h; Yield given. Multistep reaction;
With pyridine; potassium carbonate; sodium sulfite; potassium hexacyanoferrate(III); K2 1) H2O, t-BuOH, 24 h, 2) 1 h; Yield given. Multistep reaction;
tetrachloromethane
56-23-5

tetrachloromethane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,1,1,3-tetrachloro-4,4,4-trifluorobutane
129612-89-1

1,1,1,3-tetrachloro-4,4,4-trifluorobutane

Conditions
ConditionsYield
With phosphoric acid tributyl ester; iron at 110℃; for 3h;98.5%
With 2,2'-azobis(isobutyronitrile); 4-fluoroaniline; copper(I) bromide at 60℃; for 4h; Reagent/catalyst; Temperature; Autoclave; Inert atmosphere;94.2%
iron(III) chloride; phosphoric acid tributyl ester; iron at 80 - 100℃; under 2311.54 Torr;90%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,3,3,3-tetrafluoro-2-iodo-propane

1,3,3,3-tetrafluoro-2-iodo-propane

Conditions
ConditionsYield
With antimony; iodine; iodine pentafluoride; sodium iodide at 15℃; under 2250.23 Torr; Temperature; Pressure; Inert atmosphere; Large scale;98.2%
With iodine monofluoride
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

borazine
6569-51-3

borazine

2-(trifluoropropyl)borazine
155862-04-7

2-(trifluoropropyl)borazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and the propene (ratio 8.4:1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 1 h; vacuum line fractionation of mixt. through a 0, -45, -110 and -196°C trap series, product found in the -45°C trap, elem. anal.;98%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

Methyl thioglycolate
2365-48-2

Methyl thioglycolate

methyl 2-(3,3,3-trifluoropropylthio)acetate
1086277-19-1

methyl 2-(3,3,3-trifluoropropylthio)acetate

Conditions
ConditionsYield
2,2’-azobis(4-methoxy-2,4-dimethyl)valeronitrile at -78 - 20℃; for 20h; Product distribution / selectivity;98%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,2-Dibromo-3,3,3-trifluoropropane
431-21-0

1,2-Dibromo-3,3,3-trifluoropropane

Conditions
ConditionsYield
With bromine at 25℃; for 1.5h; Irradiation;96%
With bromine Irradiation;84%
With bromine
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1-(trifluoromethyl)-2-chloroethyl phenyl selenide
73194-30-6

1-(trifluoromethyl)-2-chloroethyl phenyl selenide

Conditions
ConditionsYield
In dichloromethane 1) dry ice/acetone, 2) 60 deg C, overnight;95%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

N-benzyl-N-(methoxymethyl)-N-[(trimethylsilyl)methyl]amine
93102-05-7

N-benzyl-N-(methoxymethyl)-N-[(trimethylsilyl)methyl]amine

1-benzyl-3-(trifluoromethyl)pyrrolidine

1-benzyl-3-(trifluoromethyl)pyrrolidine

Conditions
ConditionsYield
With trifluoroacetic acid In dichloromethane at -30 - 20℃; Inert atmosphere;95%
methanol
67-56-1

methanol

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,1-difluoro-3-methoxy-propene
33119-49-2

1,1-difluoro-3-methoxy-propene

Conditions
ConditionsYield
In N,N-dimethyl-formamide at 200℃; under 3750.38 Torr;93.2%
Triethoxysilane
998-30-1

Triethoxysilane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

triethoxy-(3,3,3-trifluoro-propyl)-silane
681-97-0

triethoxy-(3,3,3-trifluoro-propyl)-silane

Conditions
ConditionsYield
With platinum immobilized on polystyrene functionalized with polyethylene glycol and pyridine groups (N/Pt atom ratio of 6:1) at 60℃; under 750.075 Torr; for 6h; Sealed vessel;92.5%
RhCl(PPh3)3 at 120℃; for 24h;85%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

carbon monoxide
201230-82-2

carbon monoxide

4,4,4-trifluorobutanal
406-87-1

4,4,4-trifluorobutanal

Conditions
ConditionsYield
Stage #1: carbon monoxide With hydroxo(1,5-cyclooctadiene)rhodium (I) dimer; hydrogen; 4,5-bis(diphenylphos4,5-bis(diphenylphosphino)-9,9-dimethylxanthenephino)-9,9-dimethylxanthene In N,N-dimethyl-formamide at 100℃; under 380.026 Torr; for 1h;
Stage #2: 1,1,1-trifluoropropylene In N,N-dimethyl-formamide at 100℃; under 190.013 - 570.038 Torr; for 18h;
92%
With dichloro( 1,5-cyclooctadiene)platinum(ll); hydrogen; 4,5-bis(diphenylphos4,5-bis(diphenylphosphino)-9,9-dimethylxanthenephino)-9,9-dimethylxanthene; tin(ll) chloride In toluene at 80℃; under 72007.2 Torr; for 48h; Inert atmosphere; Autoclave; Schlenk technique; regioselective reaction;
2,2,2-trifluoroethanol
75-89-8

2,2,2-trifluoroethanol

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,1-difluoro-3-(2,2,2-trifluoro-ethoxy)-propene
2145-58-6

1,1-difluoro-3-(2,2,2-trifluoro-ethoxy)-propene

Conditions
ConditionsYield
With sodium hydroxide In 1-methyl-pyrrolidin-2-one at 60℃; under 1500.15 Torr; Autoclave;91.8%
ethanol
64-17-5

ethanol

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

3-ethoxy-1,1-difluoro-propene
1993-84-6

3-ethoxy-1,1-difluoro-propene

Conditions
ConditionsYield
With potassium hydroxide In dimethyl sulfoxide at 170℃; under 5250.53 Torr;91.2%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

2-bromo-1,1,1-trifluoropropan-3-ol
311-86-4

2-bromo-1,1,1-trifluoropropan-3-ol

Conditions
ConditionsYield
Stage #1: 1,1,1-trifluoropropylene With N-Bromosuccinimide; sulfuric acid; acetic acid at 80 - 100℃; for 4h;
Stage #2: In methanol at 40℃; for 9h;
90.2%
With water; hypobromous acid at -10℃;
With mercury(II) diacetate; water; bromine
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

tris(trifluoromethyl)phosphine
432-04-2

tris(trifluoromethyl)phosphine

A

1,1,1-trifluoropropane
421-07-8

1,1,1-trifluoropropane

B

tetrakis(trifluoromethyl)diphosphine
2714-60-5

tetrakis(trifluoromethyl)diphosphine

C

bis(trifluoromethyl)-3,3,3-trifluoropropylphosphine

bis(trifluoromethyl)-3,3,3-trifluoropropylphosphine

Conditions
ConditionsYield
Irradiation;A 1%
B 4%
C 90%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

carbon monoxide
201230-82-2

carbon monoxide

A

4,4,4-trifluorobutanal
406-87-1

4,4,4-trifluorobutanal

B

3,3,3-trifluoro-2-methylpropionaldehyde
58928-28-2

3,3,3-trifluoro-2-methylpropionaldehyde

Conditions
ConditionsYield
With hydrogen; carbonylhydridetris(triphenylphosphine)rhodium(I) In toluene at 80℃; for 15h; in an autoclave;A 2.6%
B 90%
Stage #1: carbon monoxide With hydroxo(1,5-cyclooctadiene)rhodium (I) dimer; hydrogen; 4,5-bis(diphenylphos4,5-bis(diphenylphosphino)-9,9-dimethylxanthenephino)-9,9-dimethylxanthene In N,N-dimethyl-formamide at 80℃; under 190.013 - 570.038 Torr; for 1h;
Stage #2: 1,1,1-trifluoropropylene In N,N-dimethyl-formamide at 80℃; for 15h; Solvent; Reagent/catalyst; Pressure; Temperature;
A 89%
B 1.2%
With hydrogen; dicobalt octacarbonyl 1.) toluene, room temperature, 130 atm, 2.) 100 deg C, 20 h; Yield given. Multistep reaction. Yields of byproduct given;
Dichloromethylsilane
75-54-7

Dichloromethylsilane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

(α-trifluoromethylethyl)dichloromethylsilane
84442-91-1

(α-trifluoromethylethyl)dichloromethylsilane

Conditions
ConditionsYield
With bis(benzonitrile)palladium(II) dichloride; triphenylphosphine at 100℃; for 14h;88%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

(x)C4H8O*C8H11LiSi

(x)C4H8O*C8H11LiSi

1,1-difluoro-3-(dimethylphenylsilyl)propene
88257-92-5

1,1-difluoro-3-(dimethylphenylsilyl)propene

Conditions
ConditionsYield
In benzene-d6 at 22℃; for 0.25h; Temperature; Solvent; Inert atmosphere; Schlenk technique;88%
[Ni(1,3-di-tert-butyl-imidazolin-2-ylidene)(CO)2]

[Ni(1,3-di-tert-butyl-imidazolin-2-ylidene)(CO)2]

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

A

Ni(CO)(trifluoropropene)(C3H2N2(C(CH3)3)2)

Ni(CO)(trifluoropropene)(C3H2N2(C(CH3)3)2)

B

Ni(trifluoropropene)2(C3H2N2(C(CH3)3)2)

Ni(trifluoropropene)2(C3H2N2(C(CH3)3)2)

Conditions
ConditionsYield
In pentane byproducts: CO; (Ar); a soln. of Ni complex treated with ligand, stirred for 30 min; evapd. (vac.), washed (cold pentane); elem. anal.;A 87%
B 0%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

benzenesulfenyl chloride
931-59-9

benzenesulfenyl chloride

1-(trifluoromethyl)-2-chloroethyl phenyl sulfide
73194-31-7

1-(trifluoromethyl)-2-chloroethyl phenyl sulfide

Conditions
ConditionsYield
In dichloromethane 1) dry ice/acetone, 2) 60 deg C, overnight;86%
In dichloromethane at 70℃;86%
In chloroform at 20℃; sealed glass tube;11.31 g
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

o-iodo-methyl-benzoic acid
610-97-9

o-iodo-methyl-benzoic acid

dimethyl 2'-[(1E)-3,3,3-trifluoroprop-1-en-1-yl]biphenyl-2,3'-dicarboxylate

dimethyl 2'-[(1E)-3,3,3-trifluoroprop-1-en-1-yl]biphenyl-2,3'-dicarboxylate

Conditions
ConditionsYield
Stage #1: o-iodo-methyl-benzoic acid With norbornene; tetrabutylammonium acetate; palladium diacetate; XPhos In N,N-dimethyl-formamide at 20℃; for 0.166667h; Inert atmosphere;
Stage #2: 1,1,1-trifluoropropylene In N,N-dimethyl-formamide at 115℃; under 5171.62 Torr; for 2h; Inert atmosphere; Flow reactor;
86%
Dichloromethylsilane
75-54-7

Dichloromethylsilane

1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

methyl(3,3,3-trifluoropropyl)dichlorosilane
675-62-7

methyl(3,3,3-trifluoropropyl)dichlorosilane

Conditions
ConditionsYield
RhCl(PPh3)3 at 120℃; for 12h;85%
Irradiation.unter Einwirkung von UV-Licht;
With platinum at 250℃;
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,1,1,2,2-pentamethyl-2-phenyldisilane
1130-17-2

1,1,1,2,2-pentamethyl-2-phenyldisilane

1,1-difluoro-3-(dimethylphenylsilyl)propene
88257-92-5

1,1-difluoro-3-(dimethylphenylsilyl)propene

Conditions
ConditionsYield
With tetrabutyl ammonium fluoride In tetrahydrofuran for 6h; Ambient temperature;85%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

1,2-diphenyltetramethyldisilane
1145-98-8

1,2-diphenyltetramethyldisilane

1,1-difluoro-3-(dimethylphenylsilyl)propene
88257-92-5

1,1-difluoro-3-(dimethylphenylsilyl)propene

Conditions
ConditionsYield
With tetrabutyl ammonium fluoride In N,N,N,N,N,N-hexamethylphosphoric triamide85%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

tert-butyl 4-phenylbutanoate
16537-11-4

tert-butyl 4-phenylbutanoate

t-butyl 2-phenylethyl-5,5-difluoro-4-pentenoate

t-butyl 2-phenylethyl-5,5-difluoro-4-pentenoate

Conditions
ConditionsYield
With n-butyllithium; diisopropylamine In tetrahydrofuran at -78℃;85%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

(2,4-bis(2,6-diisopropylphenylimino)pentan-3-ide-.kappa2N,N')aluminum(I)
325465-25-6

(2,4-bis(2,6-diisopropylphenylimino)pentan-3-ide-.kappa2N,N')aluminum(I)

C32H44AlF3N2

C32H44AlF3N2

Conditions
ConditionsYield
In benzene-d6 at 24.84℃; Glovebox; Schlenk technique; Inert atmosphere;85%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

C36H51AlN2

C36H51AlN2

C32H44AlF3N2

C32H44AlF3N2

Conditions
ConditionsYield
In benzene-d6 at 79.84℃; for 5h; Glovebox; Schlenk technique; Inert atmosphere;85%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

borazine
6569-51-3

borazine

A

2-(trifluoropropyl)borazine
155862-04-7

2-(trifluoropropyl)borazine

B

2,4-bis-(trifluoropropyl)borazine
155862-05-8

2,4-bis-(trifluoropropyl)borazine

C

2,4,6-tris-(trifluoropropyl)borazine
155862-06-9

2,4,6-tris-(trifluoropropyl)borazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and excess of the propene (ratio 1:2.9) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 16 h, resulting product was a solid with a moist appearance; vacuum line fractionation of mixt. through a -78 and -196°C traps, 2-substd. and 2,4-products found in the -78°C trap; extn. (CH2Cl2) of solid residue, evapn. (ac.), solid sublimed at 80°C (2,4,6-product), elem. anal.;A 14%
B 84%
C n/a

677-21-4Relevant articles and documents

Versatile Reaction Pathways of 1,1,3,3,3-Pentafluoropropene at Rh(I) Complexes [Rh(E)(PEt3)3] (E=H, GePh3, Si(OEt)3, F, Cl): C-F versus C-H Bond Activation Steps

Braun, Thomas,Talavera, Maria

supporting information, p. 11926 - 11934 (2021/07/06)

The reaction of the rhodium(I) complexes [Rh(E)(PEt3)3] (E=GePh3 (1), H (6), F (7)) with 1,1,3,3,3-pentafluoropropene afforded the defluorinative germylation products Z/E-2-(triphenylgermyl)-1,3,3,3-tetrafluoropropene and

COMPOSITIONS AND METHODS FOR AN INTEGRATED 2,3,3,3-TETRAFLUOROPROPENE MANUFACTURING PROCESS

-

Page/Page column 16; 17, (2020/02/06)

A method of synthesizing 3,3,3-trifluoropropene including contacting 1,3,3,3-tetrachloropropane, in the vapor phase, at a temperature sufficient to effect dehydrochlorination to form 1,1,3-trichloro-1-propene. The 1,1,3-trichloro-1-propene is isolated and subsequently contacted, in the vapor phase, with hydrogen fluoride in the presence of a fluorination catalyst at a temperature sufficient to effect formation of 3,3,3-trifluoropropene.

METHOD FOR PRODUCING 2-CHLORO-3,3,3-TRIFLUOROPROPENE

-

Paragraph 0027, (2019/02/13)

The invention relates to a method for producing 2-chloro-3,3,3-trifluoropropene (HCFO-1233xf) from at least one compound A selected from the group consisting of halopropane of formulae CX3CHClCH2X or CX3CFClCH3, or halopropenes of formula CQX2CCNCH2 and CX2═CClCH2X where X independently represents a fluorine or chlorine atom, characterised in that it comprises bringing said at least one compound A into contact with HF in a gaseous phase in the presence of a fluorination catalyst AlF3 or fluorine-bearing alumina in order to form a gaseous flow B comprising 2-chloro-3,3,3-trifluoropropene (HCFO-1233xf) et 3,3,3-trifluoropropene (HFO-1243zf).

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