Basic information
- Standard SMILES
O=c1ssc(-c2ccccc2)c1-c1ccccc1- InChIKey
KRDHRUKCSQIKBT-UHFFFAOYSA-N- Molecular formula
- C15H10OS2
- Average molar mass
- 270.4 g/mol
- Monoisotopic mass
- 270.01730729
Names & identifiers
- Preferred name
- 1,2-Dithiol-3-one,4,5-diphenyl
- IUPAC
- 4,5-diphenyldithiol-3-one
Names & synonyms
DTXSID908776821,2-DITHIOL-3-ONE,4,5-DIPHENYLRefChem:216192DTXCID601015751NOCAS_8776824,5-Diphenyl-3H-1,2-dithiol-3-one4,5-diphenyldithiol-3-one3H-1,2-Dithiol-3-one, 4,5-diphenyl-17835-44-8KRDHRUKCSQIKBT-UHFFFAOYSA-N4,5-Diphenyl-3H-1,2-dithiol-3-one #
Database identifiers
- PubChem CID
- 623008
- DTXSID
DTXSID90877682- Nikkaji
- J132.878F
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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