Benzene, 1,2-bis(phenylthio)-
Basic information
- CAS
3379-36-0- Standard SMILES
c1ccc(Sc2ccccc2Sc2ccccc2)cc1- InChIKey
GXYUTKVRTNINRK-UHFFFAOYSA-N- Molecular formula
- C18H14S2
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.05369279
Names & identifiers
- Preferred name
- Benzene, 1,2-bis(phenylthio)-
- IUPAC
- 1,2-bis(phenylsulfanyl)benzene
- English name
- 1,2-Bis(phenylthio)benzene
- Molecular formula
- C18H14S2
- Molecular weight
- 294.43
Names & synonyms
Benzene, 1,2-bis(phenylthio)-1,2-Bis(phenylmercapto)benzeneRefChem:562246o-Bis(phenylthio)benzene3379-36-01,2-bis(phenylsulfanyl)benzene1,2-Bis(phenylthio)benzeneAl Montgomerydi(phenylthio)benzeneSCHEMBL795029SCHEMBL1451915SCHEMBL4450055
Show more names
2-(phenylthio)diphenyl sulfide
DTXSID7063003SCHEMBL16581363GXYUTKVRTNINRK-UHFFFAOYSA-NMFCD346198321,1'-[1,2-Phenylenebis(sulfanediyl)]dibenzene
Database identifiers
- CAS
3379-36-0- PubChem CID
- 76910
- DTXSID
DTXSID7063003- Nikkaji
- J247.323B
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- form
- solid
- color
- White
- EPA Substance Registry System
- o-Bis(phenylthio)benzene (3379-36-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280-P302+P352-P362+P364
- TSCA
- TSCA listed
- HS Code
- 2904100090 · 2904100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- hs_code
- 2904100090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P302+P352-P362+P364
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,2-bis(phenylthio)-: INACTIVE
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Related reactions
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Compound notes
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