CAS 898793-21-0

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

Description:

1-Propanone, 1-(4-chloro-2-fluorophenyl)-3-(2,3-dimethylphenyl)-, identified by CAS number 898793-21-0, is an organic compound characterized by its ketone functional group. This substance features a propanone backbone with two distinct aromatic substituents: a 4-chloro-2-fluorophenyl group and a 2,3-dimethylphenyl group. The presence of chlorine and fluorine atoms in the aromatic ring contributes to its unique chemical properties, potentially influencing its reactivity and interaction with other molecules. The compound is likely to exhibit moderate polarity due to the electronegative halogen substituents, which can affect its solubility in various solvents. Additionally, the presence of multiple aromatic rings suggests potential for π-π stacking interactions, which may play a role in its behavior in biological systems or materials science applications. As with many organic compounds, safety precautions should be taken when handling this substance, including the use of appropriate personal protective equipment and adherence to safety data sheet guidelines.

Formula: C₁₇H₁₆ClFO

InChI: InChI=1S/C17H16ClFO/c1-11-4-3-5-13(12(11)2)6-9-17(20)15-8-7-14(18)10-16(15)19/h3-5,7-8,10H,6,9H2,1-2H3

InChI key: InChIKey=LFRBADRUAAHPRJ-UHFFFAOYSA-N

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

Synonyms:

• 1-(4-Chloro-2-fluorophenyl)-3-(2,3-dimethylphenyl)-1-propanone
• 4′-Chloro-3-(2,3-dimethylphenyl)-2′-fluoropropiophenone
• 1-Propanone, 1-(4-chloro-2-fluorophenyl)-3-(2,3-dimethylphenyl)-