Basic information
- CAS
29055-99-0- Standard SMILES
c1ccc(SCC(Sc2ccccc2)c2ccccc2)cc1- InChIKey
GFHICJSCVZCUGW-UHFFFAOYSA-N- Molecular formula
- C20H18S2
- Average molar mass
- 322.5 g/mol
- Monoisotopic mass
- 322.08499292
Names & identifiers
- Preferred name
- Benzene, 1,1'-((1-phenyl-1,2-ethanediyl)bis(thio))bis-
- IUPAC
- 1,2-bis(phenylsulfanyl)ethylbenzene
Names & synonyms
29055-99-0Benzene, 1,1'-((1-phenyl-1,2-ethanediyl)bis(thio))bis-RefChem:323196SCHEMBL11365816DTXSID109516551,2-bis (phenylthio)ethylbenzene1,1'-[(1-Phenylethane-1,2-diyl)disulfanediyl]dibenzene1,1'-[(1-Phenylethane-1,2-diyl)bis(sulfanediyl)]dibenzene
Database identifiers
- CAS
29055-99-0- PubChem CID
- 147296
- DTXSID
DTXSID10951655- Nikkaji
- J1.054.663J
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 286
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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