Ethanone, 1-phenyl-2-[[(phenylsulfonyl)methyl]thio]-
Basic information
- CAS
100946-65-4- Standard SMILES
O=C(CSCS(=O)(=O)c1ccccc1)c1ccccc1- InChIKey
BGMMNJTUJSBMBK-UHFFFAOYSA-N- Molecular formula
- C15H14O3S2
- Average molar mass
- 306.4 g/mol
- Monoisotopic mass
- 306.03843665
Names & identifiers
- Preferred name
- Ethanone, 1-phenyl-2-[[(phenylsulfonyl)methyl]thio]-
- IUPAC
- 2-(benzenesulfonylmethylsulfanyl)-1-phenylethanone
Names & synonyms
100946-65-4Ethanone, 1-phenyl-2-[[(phenylsulfonyl)methyl]thio]-2-{[(Benzenesulfonyl)methyl]sulfanyl}-1-phenylethan-1-oneDTXSID70545094
Database identifiers
- CAS
100946-65-4- PubChem CID
- 13615950
- DTXSID
DTXSID70545094
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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