CAS 898779-75-4

1-Propanone, 1-(2,3-dichlorophenyl)-3-(3,4-dimethylphenyl)-

Description:

1-Propanone, 1-(2,3-dichlorophenyl)-3-(3,4-dimethylphenyl)-, also known by its CAS number 898779-75-4, is an organic compound characterized by its ketone functional group. This substance features a propanone backbone with two distinct aromatic substituents: a dichlorophenyl group and a dimethylphenyl group. The presence of chlorine atoms in the dichlorophenyl moiety contributes to its chemical reactivity and potential biological activity, while the dimethylphenyl group may influence its physical properties, such as solubility and melting point. Typically, compounds of this nature are studied for their potential applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. The molecular structure suggests that it may exhibit interesting electronic properties due to the conjugation between the aromatic rings and the carbonyl group. As with many organic compounds, safety data should be consulted to understand its handling, toxicity, and environmental impact.

Formula: C₁₇H₁₆Cl₂O

InChI: InChI=1S/C17H16Cl2O/c1-11-6-7-13(10-12(11)2)8-9-16(20)14-4-3-5-15(18)17(14)19/h3-7,10H,8-9H2,1-2H3

InChI key: InChIKey=QTOABSVSJSQTDF-UHFFFAOYSA-N

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

Synonyms:

• 2′,3′-Dichloro-3-(3,4-dimethylphenyl)propiophenone
• 1-Propanone, 1-(2,3-dichlorophenyl)-3-(3,4-dimethylphenyl)-
• 1-(2,3-Dichlorophenyl)-3-(3,4-dimethylphenyl)-1-propanone