CAS 898754-02-4

1-(3,4-dichlorophenyl)-3-(2,5-dimethylphenyl)propan-1-one

Description:

1-(3,4-Dichlorophenyl)-3-(2,5-dimethylphenyl)propan-1-one, with the CAS number 898754-02-4, is an organic compound characterized by its ketone functional group. It features a propanone backbone substituted with a dichlorophenyl group at one end and a dimethylphenyl group at the other. This compound is typically a solid at room temperature and may exhibit a crystalline structure. Its molecular structure suggests potential applications in organic synthesis and medicinal chemistry, particularly due to the presence of halogen and alkyl substituents, which can influence its reactivity and biological activity. The dichlorophenyl moiety may enhance lipophilicity, while the dimethylphenyl group can affect steric hindrance and electronic properties. As with many organic compounds, it is essential to handle this substance with care, considering its potential toxicity and environmental impact. Proper safety protocols should be followed during its synthesis and application in research or industrial settings.

Formula: C₁₇H₁₆Cl₂O

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

SMILES: Cc1ccc(C)c(CCC(=O)c2ccc(c(c2)Cl)Cl)c1