Basic information
- Standard SMILES
CSc1ccc(CC(=O)c2ccccc2)cc1- InChIKey
TZNHIWAKRVUVEB-UHFFFAOYSA-N- Molecular formula
- C15H14OS
- Average molar mass
- 242.3 g/mol
- Monoisotopic mass
- 242.07653624
Names & identifiers
- Preferred name
- 1-Phenyl-2-(4-(methylthio)phenyl)ethanone
- IUPAC
- 2-(4-methylsulfanylphenyl)-1-phenylethanone
Names & synonyms
SCHEMBL6168844TZNHIWAKRVUVEB-UHFFFAOYSA-N1-Phenyl-2-(4-(methylthio)phenyl)ethanone
Database identifiers
- PubChem CID
- 22009557
- Nikkaji
- J3.058.186E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 237
Related reactions
5 records
Compound notes
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