CAS 845781-21-7

1-(3-Chloro-5-fluorophenyl)-2-phenylethanone

Description:

1-(3-Chloro-5-fluorophenyl)-2-phenylethanone, with the CAS number 845781-21-7, is an organic compound characterized by its ketone functional group and aromatic structure. It features a phenyl group attached to a carbonyl (C=O) moiety, which is further substituted with a 3-chloro-5-fluorophenyl group. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents due to its hydrophobic aromatic rings. The presence of chlorine and fluorine substituents can influence its reactivity and polarity, potentially enhancing its biological activity or interaction with other chemical species. As a ketone, it may participate in various chemical reactions, including nucleophilic additions and condensation reactions. Its unique structure suggests potential applications in pharmaceuticals, agrochemicals, or as a building block in organic synthesis. Safety data should be consulted for handling and storage, as halogenated compounds can pose specific health and environmental risks.

Formula: C₁₄H₁₀ClFO

InChI: InChI=1S/C14H10ClFO/c15-12-7-11(8-13(16)9-12)14(17)6-10-4-2-1-3-5-10/h1-5,7-9H,6H2

InChI key: InChIKey=JYPKPMJHTOUUBX-UHFFFAOYSA-N

SMILES: C(CC1=CC=CC=C1)(=O)C2=CC(Cl)=CC(F)=C2

Synonyms:

• Ethanone, 1-(3-chloro-5-fluorophenyl)-2-phenyl-
• 3′-Chloro-5′-fluoro-2-phenylacetophenone
• 1-(3-Chloro-5-fluorophenyl)-2-phenylethanone