Basic information
- CAS
142836-12-2- Standard SMILES
O=C(CC1C=CS(=O)(=O)C1)c1ccccc1- InChIKey
WOCPSQRGTSVPNX-UHFFFAOYSA-N- Molecular formula
- C12H12O3S
- Average molar mass
- 236.29 g/mol
- Monoisotopic mass
- 236.05071541
Names & identifiers
- Preferred name
- Ethanone, 2-(2,3-dihydro-1,1-dioxido-3-thienyl)-1-phenyl-
- IUPAC
- 2-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-1-phenylethanone
Names & synonyms
Ethanone, 2-(2,3-dihydro-1,1-dioxido-3-thienyl)-1-phenyl-142836-12-2DTXSID10405567RefChem:341358DTXCID70356420Oprea1_4319763-(2-Oxo-2-phenylethyl)-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
Database identifiers
- CAS
142836-12-2- PubChem CID
- 4686341
- DTXSID
DTXSID10405567
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 383
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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