Ethynyl(pentafluoro)-$l^{6}-sulfane

Base Information

• Chemical Name: Ethynyl(pentafluoro)-$l^{6}-sulfane
• CAS No.: 917-89-5
• Molecular Formula: C2H F5 S
• Molecular Weight: 152.09
• DSSTox Substance ID: DTXSID50382040
• Nikkaji Number: J1.531.656J
• Wikidata: Q82173323
• Mol file: 917-89-5.mol

Synonyms:917-89-5;ethynyl(pentafluoro)-$l^{6}-sulfane;ETHYNYLSULFURPENTAFLUORIDE;ethynyl(pentafluoro)-lambda6-sulfane;ethynylpentafluorosulfur;Ethynyl(pentafluoro)-sulfane;Ethynylpentafluorosulfur(VI);SCHEMBL942868;DTXSID50382040;ETHYNYLPENTAFLUORO-??-SULFANE;AKOS006228991;ethynyl-pentakis(fluoranyl)-$l^{6}-sulfane;A844067

Chemical Property of Ethynyl(pentafluoro)-$l^{6}-sulfane

Chemical Property:

• Boiling Point: 6°C
• PSA: 25.30000
• LogP: 2.87560
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 151.97191202
• Heavy Atom Count: 8
• Complexity: 149

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 10-23
• Safety Statements: 16-26-38

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CS(F)(F)(F)(F)F
• Uses: Ethynylsulfur Pentafluoride is a useful building block for organic synthesis processes.

Technology Process of Ethynyl(pentafluoro)-$l^{6}-sulfane

There total 3 articles about Ethynyl(pentafluoro)-$l^{6}-sulfane 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: 65.0%

(1-bromo-2-chloro-vinyl)-pentafluoro-λ6-sulfane (14465-64-6,14465-65-7) → (pentafluorosulfanyl)acetylene (917-89-5)

Guidance literature:

With zinc; In diethylene glycol dimethyl ether; at 140 ℃; for 3h;

Reference yield:

(1,2-Dibrom-2-chlorethyl)schwefelpentafluorid (920-60-5) → (pentafluorosulfanyl)acetylene (917-89-5)

Guidance literature:

Multistep reaction; (i) K₂CO₃, acetone, (ii) Zn, diglyme;

DOI:10.1021/jo01035a030

Reference yield:

→ (pentafluorosulfanyl)acetylene (917-89-5)

Guidance literature:

1-Brom-2-chlorvinyl-schwefelpentafluorid, Eintragen in ein h. Gemisch aus Zn-staub/Diethylenglykol-dimethylether/N2;

DOI:10.1021/jo01035a030

upstream raw materials:

(1,2-Dibrom-2-chlorethyl)schwefelpentafluorid

(1-bromo-2-chloro-vinyl)-pentafluoro-λ⁶-sulfane

Downstream raw materials:

1,2-Dimethyl-4-pentafluormercapto-cyclohexadien-(1,4)

2-Pentafluormercapto-cyclopentadien-(1,4)

Refernces