Bis(2-chlorophenyl) sulfide

Base Information

• Chemical Name: Bis(2-chlorophenyl) sulfide
• CAS No.: 5097-95-0
• Molecular Formula: C12H8Cl2S
• Molecular Weight: 255.168
• Hs Code.: 2930909090
• UNII: 2S5M7DN170
• DSSTox Substance ID: DTXSID401307019
• Nikkaji Number: J80.951I
• Wikidata: Q27255536
• Mol file: 5097-95-0.mol

Synonyms:Bis(2-chlorophenyl) sulfide;1,1'-Dithiobis(2-chlorobenzene);Sulfide, bis(o-chlorophenyl);5097-95-0;Benzene, 1,1'-thiobis(2-chloro-;UNII-2S5M7DN170;2S5M7DN170;1,1'-Thiobis[2-chlorobenzene];1,1'-THIOBIS(2-CHLOROBENZENE);chlorophenyl sulfide;SCHEMBL6915666;DTXSID401307019;Q27255536

Chemical Property of Bis(2-chlorophenyl) sulfide

Chemical Property:

• PSA: 25.30000
• LogP: 5.14460
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 253.9723768
• Heavy Atom Count: 15
• Complexity: 178

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)SC2=CC=CC=C2Cl)Cl

Technology Process of Bis(2-chlorophenyl) sulfide

There total 9 articles about Bis(2-chlorophenyl) 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: 94.0%

bis(2-chlorobenzene)disulfide (31121-19-4) → 2,2'-dichrolodiphenyl sulfide (5097-95-0)

Guidance literature:

With copper(l) iodide; 1,10-Phenanthroline; potassium carbonate; In water; dimethyl sulfoxide; at 120 ℃;

DOI:10.1021/acscatal.9b04931

Reference yield: 94.0%

2-bromo-1-chlorobenzene (694-80-4) → 2,2'-dichrolodiphenyl sulfide (5097-95-0)

Guidance literature:

With potassium phosphate; copper(l) iodide; sodiumsulfide nonahydrate; at 150 ℃; for 24h;

DOI:10.1080/10426507.2012.694003

Reference yield: 85.0%

2-Chlorobenzeneboronic acid (3900-89-8) → 2,2'-dichrolodiphenyl sulfide (5097-95-0)

Guidance literature:

With octasulfur; copper(l) iodide; 1,10-Phenanthroline; ammonium tetrafluoroborate; In water; dimethyl sulfoxide; at 100 ℃; for 36h;

DOI:10.1016/j.tet.2016.08.012

upstream raw materials:

1,2-dichloro-benzene

ethanethiol

acetylene

2-bromo-1-chlorobenzene

Downstream raw materials:

bis(2-chlorophenyl) sulfone

2,2'-Dichlorobiphenyl

2,2'-sulfinylbis(chlorobenzene)