2-[(2-Chlorophenyl)thio]-1-(3-fluorophenyl)ethanone
Basic information
- CAS
1152841-32-1- Standard SMILES
O=C(CSc1ccccc1Cl)c1cccc(F)c1- InChIKey
OYPSOMXASFVYKW-UHFFFAOYSA-N- Molecular formula
- C14H10ClFOS
- Average molar mass
- 280.7 g/mol
- Monoisotopic mass
- 280.012492
Names & identifiers
- Preferred name
- 2-[(2-Chlorophenyl)thio]-1-(3-fluorophenyl)ethanone
- IUPAC
- 2-(2-chlorophenyl)sulfanyl-1-(3-fluorophenyl)ethanone
Names & synonyms
2-[(2-Chlorophenyl)thio]-1-(3-fluorophenyl)ethanoneDTXSID101221539AKOS0058985371152841-32-12-[(2-Chlorophenyl)sulfanyl]-1-(3-fluorophenyl)ethan-1-one
Database identifiers
- CAS
1152841-32-1- PubChem CID
- 43226506
- DTXSID
DTXSID101221539
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 287
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Compound notes
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