CAS 898769-49-8

1-Cyclopropyl-3-(4-methylphenyl)-1-propanone

Description:

1-Cyclopropyl-3-(4-methylphenyl)-1-propanone, with the CAS number 898769-49-8, is an organic compound characterized by its unique structure that includes a cyclopropyl group and a phenyl group substituted with a methyl group. This compound typically appears as a colorless to pale yellow liquid and is known for its potential applications in organic synthesis and as an intermediate in the production of pharmaceuticals. Its molecular structure features a ketone functional group, which contributes to its reactivity and potential for undergoing various chemical transformations. The presence of the cyclopropyl ring can impart distinctive steric and electronic properties, influencing its behavior in chemical reactions. Additionally, the compound's aromatic ring can participate in electrophilic substitution reactions, making it versatile in synthetic chemistry. Safety data sheets should be consulted for handling and storage guidelines, as with many organic compounds, it may pose health risks if not managed properly. Overall, 1-Cyclopropyl-3-(4-methylphenyl)-1-propanone is a noteworthy compound in the realm of organic chemistry.

Formula: C₁₃H₁₆O

InChI: InChI=1S/C13H16O/c1-10-2-4-11(5-3-10)6-9-13(14)12-7-8-12/h2-5,12H,6-9H2,1H3

InChI key: InChIKey=OUAUZMGYEYWRTK-UHFFFAOYSA-N

SMILES: C(CCC1=CC=C(C)C=C1)(=O)C2CC2

Synonyms:

• 1-Propanone, 1-cyclopropyl-3-(4-methylphenyl)-
• 1-Cyclopropyl-3-(4-methylphenyl)-1-propanone