CAS 898792-95-5

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

Description:

1-Propanone, 1-(3-chloro-4-fluorophenyl)-3-(2,3-dimethylphenyl)-, also known by its CAS number 898792-95-5, is an organic compound characterized by its ketone functional group. This substance features a propanone backbone with two distinct aromatic substituents: a 3-chloro-4-fluorophenyl group and a 2,3-dimethylphenyl 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 dimethyl substitution on the phenyl ring can affect steric hindrance and electronic distribution, potentially impacting its chemical behavior in reactions. As a ketone, it may participate in nucleophilic addition reactions and can serve as a precursor in various synthetic pathways. Safety data and handling precautions should be considered, as with any chemical, due to potential toxicity or environmental impact. Overall, this compound's unique structure suggests potential applications in pharmaceuticals or materials science, warranting further investigation into its properties and uses.

Formula: C₁₇H₁₆ClFO

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

InChI key: InChIKey=VHRHVEAYSSLUIW-UHFFFAOYSA-N

SMILES: C(CCC1=C(C)C(C)=CC=C1)(=O)C2=CC(Cl)=C(F)C=C2

Synonyms:

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