CAS 898791-34-9

2-(Cyclopentylcarbonyl)benzonitrile

Description:

2-(Cyclopentylcarbonyl)benzonitrile, identified by its CAS number 898791-34-9, is an organic compound characterized by its unique structure, which includes a benzonitrile moiety and a cyclopentylcarbonyl group. This compound features a cyano group (-CN) attached to a benzene ring, which contributes to its potential applications in organic synthesis and pharmaceuticals. The cyclopentylcarbonyl group introduces a cyclic aliphatic component, enhancing the compound's steric and electronic properties. Typically, compounds of this nature exhibit moderate to high lipophilicity, which can influence their solubility in organic solvents and their behavior in biological systems. The presence of the cyano group may also impart specific reactivity, making it a useful intermediate in various chemical reactions, including nucleophilic additions and substitutions. Additionally, the compound's structural characteristics may allow for interactions with biological targets, suggesting potential utility in medicinal chemistry. Overall, 2-(Cyclopentylcarbonyl)benzonitrile represents a versatile building block in organic synthesis with implications in various fields, including drug development and materials science.

Formula: C₁₃H₁₃NO

InChI: InChI=1S/C13H13NO/c14-9-11-7-3-4-8-12(11)13(15)10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6H2

InChI key: InChIKey=GBEFWVXZZRTNFV-UHFFFAOYSA-N

SMILES: C(=O)(C1=C(C#N)C=CC=C1)C2CCCC2

Synonyms:

• 2-(Cyclopentanecarbonyl)benzonitrile
• Benzonitrile, 2-(cyclopentylcarbonyl)-
• 2-Cyclopentanecarbonylbenzonitrile
• 2-(Cyclopentylcarbonyl)benzonitrile
• 2-Cyanophenyl cyclopentyl ketone

2-Cyanophenyl cyclopentyl ketone

CAS: 898791-34-9

Formula: C₁₃H₁₃NO

Purity: 97.0%

Molecular weight: 199.253

Ref: 10-F204111