1-[(S)-(4-Bromophenyl)methanesulfinyl]propan-2-one
Basic information
- CAS
675576-74-6- Standard SMILES
CC(=O)C[S@@](=O)Cc1ccc(Br)cc1- InChIKey
RIFOTNHWHOQUQJ-CQSZACIVSA-N- Molecular formula
- C10H11BrO2S
- Average molar mass
- 275.16 g/mol
- Monoisotopic mass
- 273.96631
Names & identifiers
- Preferred name
- 1-[(S)-(4-Bromophenyl)methanesulfinyl]propan-2-one
- IUPAC
- 1-[(S)-(4-bromophenyl)methylsulfinyl]propan-2-one
Names & synonyms
675576-74-61-[(S)-(4-Bromophenyl)methanesulfinyl]propan-2-oneDTXSID60791169
Database identifiers
- CAS
675576-74-6- PubChem CID
- 71368089
- DTXSID
DTXSID60791169
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 222
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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