CAS 898761-33-6

7-Chloro-1-(3-fluoro-4-methylphenyl)-1-heptanone

Description:

7-Chloro-1-(3-fluoro-4-methylphenyl)-1-heptanone, identified by its CAS number 898761-33-6, is an organic compound characterized by its ketone functional group and a complex aromatic structure. This compound features a heptanone backbone, which consists of a seven-carbon chain with a ketone functional group at one end. The presence of a chloro substituent at the seventh carbon and a 3-fluoro-4-methylphenyl group at the first carbon contributes to its unique chemical properties and potential biological activity. The fluorine and chlorine atoms can influence the compound's reactivity, polarity, and overall stability. Additionally, the aromatic ring enhances its lipophilicity, which may affect its solubility in organic solvents. Such compounds are often of interest in medicinal chemistry and drug development due to their potential pharmacological properties. However, specific applications and safety profiles would require further investigation and analysis in a laboratory setting.

Formula: C₁₄H₁₈ClFO

InChI: InChI=1S/C14H18ClFO/c1-11-7-8-12(10-13(11)16)14(17)6-4-2-3-5-9-15/h7-8,10H,2-6,9H2,1H3

InChI key: InChIKey=XMQIRTSXUDZEOE-UHFFFAOYSA-N

SMILES: C(CCCCCCCl)(=O)C1=CC(F)=C(C)C=C1

Synonyms:

• 1-Heptanone, 7-chloro-1-(3-fluoro-4-methylphenyl)-
• 7-Chloro-1-(3-fluoro-4-methylphenyl)-1-heptanone

7-chloro-1-(3-fluoro-4-methylphenyl)-1-oxoheptane

CAS: 898761-33-6

Formula: C₁₄H₁₈ClFO

Purity: 97.0%

Molecular weight: 256.75

Ref: 10-F206915