Trifluoroethanethioyl fluoride

Base Information

• Chemical Name: Trifluoroethanethioyl fluoride
• CAS No.: 754-13-2
• Molecular Formula: C2F4S
• Molecular Weight: 132.082
• UNII: SWV59R4XB0
• DSSTox Substance ID: DTXSID20518672
• Wikidata: Q82381452
• Mol file: 754-13-2.mol

Synonyms:trifluorothioacetyl fluoride;754-13-2;SWV59R4XB0;2,2,2-trifluoroethanethioyl fluoride;Trifluoroethanethioyl fluoride;UNII-SWV59R4XB0;Ethanethioyl fluoride, 2,2,2-trifluoro-;Ethanethioyl fluoride, trifluoro-;SCHEMBL2802029;DTXSID20518672;GJEYOMRYFSEJBX-UHFFFAOYSA-N

Chemical Property of Trifluoroethanethioyl fluoride

Chemical Property:

• Boiling Point: -21 °C
• PSA: 32.09000
• Density: 1.494±0.06 g/cm3(Predicted)
• LogP: 1.84560
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 131.96568382
• Heavy Atom Count: 7
• Complexity: 82.2

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(=S)(C(F)(F)F)F

Technology Process of Trifluoroethanethioyl fluoride

There total 4 articles about Trifluoroethanethioyl fluoride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

1-chloro-1,2,2,2-tetrafluoroethanesulphinyl chloride (38346-18-8) → trifluoroacetyl fluoride (354-34-7) + trifluorothioacetyl fluoride (754-13-2) + fluorotrifluoromethylsulphine (141062-59-1,88725-14-8)

Guidance literature:

With copper;

DOI:10.1016/S0022-1139(00)85432-9

Reference yield: 1.0%

1-Chlor-1,2,2,2-tetrafluorethansulfenylchlorid (57160-01-7) → trifluoracetyl chloride (354-32-5) + trifluorothioacetyl fluoride (754-13-2)

Guidance literature:

With Cu-cuttings; In gas; at 400 ℃; under 0.008 Torr;

Reference yield:

polytetrafluoroethylene (116-14-3,82785-14-6) + sulfur (7704-34-9) → thiocarbonyl fluoride (420-32-6) + Bis(trifluoromethyl)disulfid (372-64-5) + trifluorothioacetyl fluoride (754-13-2)

Guidance literature:

500-600°C;

DOI:10.1021/jo01016a008

upstream raw materials:

1-chloro-1,2,2,2-tetrafluoroethanesulphinyl chloride

1-Chlor-1,2,2,2-tetrafluorethansulfenylchlorid

pentafluoro ethanethiol

polytetrafluoroethylene

Downstream raw materials:

(perfluoroprop-1-ene-1,1-diyl)dibenzene

2,2,3-trifluoro-3-trifluoromethylthiirane

trifluoroacetyl fluoride