o-Bis(phenylthio)benzene

Base Information

• Chemical Name: o-Bis(phenylthio)benzene
• CAS No.: 3379-36-0
• Molecular Formula: C18H14S2
• Molecular Weight: 294.441
• Hs Code.: 2904100090
• DSSTox Substance ID: DTXSID7063003
• Nikkaji Number: J247.323B
• Wikidata: Q81990420
• Mol file: 3379-36-0.mol

Synonyms:o-Bis(phenylthio)benzene;1,2-bis(phenylsulfanyl)benzene;3379-36-0;Benzene, 1,2-bis(phenylthio)-;1,2-Bis(phenylmercapto)benzene;1,2-Bis(phenylthio)benzene;di(phenylthio)benzene;SCHEMBL795029;DTXSID7063003;C18-H14-S2

Chemical Property of o-Bis(phenylthio)benzene

Chemical Property:

• Vapor Pressure: 6.03E-07mmHg at 25°C
• Boiling Point: 422.2°Cat760mmHg
• Flash Point: 210.7°C
• PSA: 50.60000
• Density: 1.23g/cm³
• LogP: 5.98900
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 294.05369279
• Heavy Atom Count: 20
• Complexity: 239

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)SC2=CC=CC=C2SC3=CC=CC=C3

Technology Process of o-Bis(phenylthio)benzene

There total 26 articles about o-Bis(phenylthio)benzene 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: 99.0%

thiophenol (108-98-5) + 2,3-dibromobenzene (583-53-9) → 1,2-bis(phenylthio)benzene (3379-36-0)

Guidance literature:

With 1,2,3,4-tetrahydroquinolin-8-ol; caesium carbonate; copper(I) bromide; In N,N-dimethyl-formamide; at 130 ℃; for 48h; chemoselective reaction; Inert atmosphere;

DOI:10.1055/s-0030-1258234

Reference yield: 94.0%

1-Bromo-2-iodobenzene (583-55-1) + thiophenol (108-98-5) → 1,2-bis(phenylthio)benzene (3379-36-0)

Guidance literature:

With copper(l) iodide; trans-1,2-cyclohexandiol; potassium carbonate; In isopropyl alcohol; at 120 ℃; for 3h; Microwave irradiation;

DOI:10.1016/j.tetlet.2009.03.115

Reference yield: 94.0%

1,2-Diiodobenzene (615-42-9) + diphenyldisulfane (882-33-7) → 1,2-bis(phenylthio)benzene (3379-36-0)

Guidance literature:

With copper(l) iodide; 1-(2-hydroxyphenyl)-3-dimethylaminoprop-2-enone; caesium carbonate; In ethanol; at 80 ℃; for 15h; Temperature; Solvent; Reagent/catalyst; Catalytic behavior; Green chemistry;

DOI:10.1039/c4ra02935f

upstream raw materials:

copper(I) thiophenolate

1,2-dichloro-benzene

2,3-dibromobenzene

2-iodochlorobenzene

Downstream raw materials:

1,2-bis(phenylsulphonyl)benzene

dibromo[1,2-bis(phenylthio)benzene]platinum(II)

[Os(o-C₆H₄(SPh)2)Cl₄]

dichloro[1,2-bis(phenylthio)benzene]platinum(II)