Pentafluorophenyl sulfide

Base Information

• Chemical Name: Pentafluorophenyl sulfide
• CAS No.: 1043-50-1
• Molecular Formula: C12F10S
• Molecular Weight: 366.182
• Hs Code.: 2930909090
• European Community (EC) Number: 213-874-5
• DSSTox Substance ID: DTXSID20146378
• Nikkaji Number: J120.854C
• Wikidata: Q69755174
• Mol file: 1043-50-1.mol

Synonyms:Pentafluorophenyl sulfide;1043-50-1;Decafluorodiphenyl sulfide;Decafluorodiphenyl sulphide;Bis(pentafluorophenyl) sulfide;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfanylbenzene;Sulfide, bis(pentafluorophenyl);Bis(2,3,4,5,6-pentafluorophenyl) sulphide;EINECS 213-874-5;Benzene, 1,1'-thiobis[2,3,4,5,6-pentafluoro-;Benzene, 1,1'-thiobis(2,3,4,5,6-pentafluoro-;C12F10S;Perfluorodiphenyl sulfide;bis(perfluorophenyl)sulfane;SCHEMBL575707;Pentafluorophenyl sulfide, 98%;DTXSID20146378;BBL101657;C12-F10-S;MFCD00000293;STL555453;AKOS007930250;GS-3519;1,1'-sulfanediylbis(pentafluorobenzene);FT-0624479;Benzene, 1,1'-thiobis*2,3,4,5,6-pentafluoro-;J-001155;1,2,3,4,5-Pentafluoro-6-[(2,3,4,5,6-pentafluorophenyl)sulfanyl]benzene;1,2,3,4,5-Pentafluoro-6-[(2,3,4,5,6-pentafluorophenyl)sulfanyl]benzene #

Chemical Property of Pentafluorophenyl sulfide

Chemical Property:

• Appearance/Colour: WHITE TO OFF-WHITE POWDER OR CRYSTALS
• Vapor Pressure: 0.498mmHg at 25°C
• Melting Point: 86-88 °C(lit.)
• Refractive Index: 1.486
• Boiling Point: 198.8 °C at 760 mmHg
• Flash Point: 74 °C
• PSA: 25.30000
• Density: 1.73 g/cm³
• LogP: 5.22880
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 2
• Exact Mass: 365.95610279
• Heavy Atom Count: 23
• Complexity: 345

Purity/Quality:

98%,99%, ^*data from raw suppliers

PentafluorophenylSulfide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,N
• Hazard Codes: Xi,N
• Statements: 36/37/38-50/53
• Safety Statements: 26-37/39-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=C(C(=C(C(=C1F)F)SC2=C(C(=C(C(=C2F)F)F)F)F)F)F)F

Technology Process of Pentafluorophenyl sulfide

There total 69 articles about Pentafluorophenyl sulfide 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: 100.0%

bis(pentafluorophenyl)telluride (18064-76-1) → pentafluorophenyl sulfide (1043-50-1)

Guidance literature:

With sulfur; at 230°C, in vac.;

Reference yield: 97.0%

Pentafluorobenzene (363-72-4) + bis(pentafluorophenyl) disulfide (1494-06-0) → pentafluorophenyl sulfide (1043-50-1)

Guidance literature:

In further solvent(s); in SbF5, 50°C, 1 h;

Reference yield: 95.0%

pentafluorobenzenesulfenyl chloride (27918-31-6) + Pentafluorobenzene (363-72-4) → pentafluorophenyl sulfide (1043-50-1)

Guidance literature:

With antimony pentafluoride;

upstream raw materials:

1-chloro-2,3,4,5,6-pentafluorobenzene

hydrogen sulfide

perfluoropropylene

bis(pentafluorophenyl) disulfide

Downstream raw materials:

octafluorodibenzothiophene

Pentafluorobenzene

(4-CH₃OC₆F₄)2S

1,1′-sulfanediylbis(2,3,5,6-tetrafluorobenzene)

Refernces

• 1、 Golloch,Sartori. "". . p. 52. Retrieved 1973.
• 2、 Deacon,Johnson. "". . p. 271. Retrieved 1972.
• 3、 Kitazume,T.,Shreeve,J.M.. "-". . p. 492 - 496. Retrieved 1978.
• 4、 Yakobson et al.. "". . . Retrieved 1972.
• 5、 Burdon, J.,Coe, P. L.,Fulton, M.. "". . . Retrieved 1965.
• 6、 Zhang, Shiyu,Celebi-Oelcuem, Nihan,Melzer, Marie M.,Houk,Warren, Timothy H.. "Copper(I) nitrosyls from reaction of copper(II) thiolates with S-nitrosothiols: Mechanism of NO release from RSNOs at Cu". . p. 16746 - 16749. Retrieved 2013/12/04.