Hexakis[(trifluoromethyl)sulfanyl]ethane

Base Information

• Chemical Name: Hexakis[(trifluoromethyl)sulfanyl]ethane
• CAS No.: 62872-38-2
• Molecular Formula: C8F18S6
• Molecular Weight: 630.455
• DSSTox Substance ID: DTXSID80570054
• Wikidata: Q82457367

Synonyms:62872-38-2;Hexakis[(trifluoromethyl)sulfanyl]ethane;DTXSID80570054;hexakis[(trifluoromethyl)thio]ethane

Chemical Property of Hexakis[(trifluoromethyl)sulfanyl]ethane

Chemical Property:

• PSA: 151.80000
• LogP: 9.81200
• XLogP3: 11.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 24
• Rotatable Bond Count: 7
• Exact Mass: 629.8036840
• Heavy Atom Count: 32
• Complexity: 470

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(SC(F)(F)F)(SC(F)(F)F)SC(F)(F)F)(SC(F)(F)F)(SC(F)(F)F)SC(F)(F)F

Technology Process of Hexakis[(trifluoromethyl)sulfanyl]ethane

There total 4 articles about Hexakis[(trifluoromethyl)sulfanyl]ethane 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:

hexane (110-54-3) + bis(trifluoromethyl)trithiocarbonate (461-08-5) → trifluoromethylsulfide (1493-15-8) + bis-(trifluoromethyl)sulfide (371-78-8) + Bis(trifluoromethyl)disulfid (372-64-5) + tetrakis(trifluoromethylsulfanyl)ethylene (13003-40-2) + hexakis(trifluoromethylsulfanyl)ethane (62872-38-2) + 1-[(trifluoromethyl)thio]hexane (59529-76-9)

Guidance literature:

at 68.9 ℃; Product distribution; Mechanism; Irradiation;

Reference yield:

bis(trifluoromethyl)trithiocarbonate (461-08-5) + pentane (109-66-0,8031-35-4,9078-70-0) → trifluoromethylsulfide (1493-15-8) + bis-(trifluoromethyl)sulfide (371-78-8) + Bis(trifluoromethyl)disulfid (372-64-5) + tetrakis(trifluoromethylsulfanyl)ethylene (13003-40-2) + hexakis(trifluoromethylsulfanyl)ethane (62872-38-2) + 1-Trifluoromethylsulfanyl-pentane

Guidance literature:

at -73.1 ℃; Product distribution; Mechanism; Irradiation; further temperatures;

Reference yield:

n-heptane (142-82-5) + bis(trifluoromethyl)trithiocarbonate (461-08-5) → bis-(trifluoromethyl)sulfide (371-78-8) + Bis(trifluoromethyl)disulfid (372-64-5) + tris(trifluoromethylthio)methane (691-69-0) + tetrakis(trifluoromethylsulfanyl)ethylene (13003-40-2) + hexakis(trifluoromethylsulfanyl)ethane (62872-38-2) + 1-[(trifluoromethyl)thio]hexane (59529-76-9)

Guidance literature:

at 68.9 ℃; Product distribution; Mechanism; Irradiation; in dependence on time;

upstream raw materials:

hexane

bis(trifluoromethyl)trithiocarbonate

n-heptane

pentane

Downstream raw materials:

Bis(trifluoromethyl)disulfid

tris(trifluoromethylthio)methane

tetrakis(trifluoromethylsulfanyl)ethylene

di-tert-butyl nitroxide

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