CAS 898775-04-7

1-Propanone, 1-(2-chloro-4-fluorophenyl)-3-(3-methoxyphenyl)-

Description:

1-Propanone, 1-(2-chloro-4-fluorophenyl)-3-(3-methoxyphenyl)-, identified by CAS number 898775-04-7, is an organic compound characterized by its ketone functional group, which is central to its structure. This compound features a propanone backbone with two distinct aromatic substituents: a 2-chloro-4-fluorophenyl group and a 3-methoxyphenyl group. The presence of halogen atoms, such as chlorine and fluorine, often influences the compound's reactivity and physical properties, including its boiling point and solubility. The methoxy group contributes to the compound's electron-donating characteristics, potentially affecting its chemical behavior in reactions. As a ketone, it may participate in nucleophilic addition reactions and can serve as an important intermediate in organic synthesis. The specific arrangement of substituents can also impact the compound's biological activity, making it of interest in pharmaceutical research. Overall, this compound exemplifies the complexity and diversity of organic molecules, with potential applications in various fields, including medicinal chemistry and materials science.

Formula: C₁₆H₁₄ClFO₂

InChI: InChI=1S/C16H14ClFO2/c1-20-13-4-2-3-11(9-13)5-8-16(19)14-7-6-12(18)10-15(14)17/h2-4,6-7,9-10H,5,8H2,1H3

InChI key: InChIKey=JVOIUBCVWOHDEB-UHFFFAOYSA-N

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

Synonyms:

• 2′-Chloro-4′-fluoro-3-(3-methoxyphenyl)propiophenone
• 1-Propanone, 1-(2-chloro-4-fluorophenyl)-3-(3-methoxyphenyl)-
• 1-(2-Chloro-4-fluorophenyl)-3-(3-methoxyphenyl)-1-propanone