Basic information
- Standard SMILES
O=C(Cc1ccc(F)cc1)c1ccnc(Cl)c1- InChIKey
VAFVEHCOUYITDQ-UHFFFAOYSA-N- Molecular formula
- C13H9ClFNO
- Average molar mass
- 249.67 g/mol
- Monoisotopic mass
- 249.0356698
Names & identifiers
- Preferred name
- 1-(2-Chloropyridin-4-yl)-2-(4-fluorophenyl)ethanone
- IUPAC
- 1-(2-chloro-4-pyridinyl)-2-(4-fluorophenyl)ethanone
Names & synonyms
SCHEMBL6641863VAFVEHCOUYITDQ-UHFFFAOYSA-NAKOS0190250741-(2-chloropyridin-4-yl)-2-(4-fluorophenyl)ethanone1-(2-chloropyridin-4-yl)-2-(4-fluoro-phenyl)ethanone
Database identifiers
- PubChem CID
- 22987969
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 266
Related reactions
3 records
Compound notes
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