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CAS 284022-94-2

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4-(3-Oxocyclopentyl)benzonitrile

Description:
4-(3-Oxocyclopentyl)benzonitrile, identified by its CAS number 284022-94-2, is an organic compound characterized by the presence of both a benzonitrile moiety and a cyclopentyl ketone group. The structure features a cyano group (-CN) attached to a benzene ring, which contributes to its potential applications in organic synthesis and medicinal chemistry. The cyclopentyl ring, substituted with a ketone functional group, introduces unique steric and electronic properties that can influence the compound's reactivity and interactions. This compound may exhibit interesting biological activities, making it a candidate for further research in drug development. Its physical properties, such as solubility, melting point, and boiling point, would depend on the specific molecular interactions and the presence of functional groups. As with many organic compounds, safety data and handling precautions should be considered, particularly due to the presence of the nitrile group, which can be toxic. Overall, 4-(3-Oxocyclopentyl)benzonitrile represents a versatile structure in the realm of organic chemistry.
Formula:C12H11NO
InChI:InChI=1S/C12H11NO/c13-8-9-1-3-10(4-2-9)11-5-6-12(14)7-11/h1-4,11H,5-7H2
InChI key:InChIKey=DAJJPEJONXVOKT-UHFFFAOYSA-N
SMILES:O=C1CC(CC1)C2=CC=C(C#N)C=C2
Synonyms:
  • 4-(3-Oxocyclopentyl)Benzonitrile
  • Benzonitrile, 4-(3-oxocyclopentyl)-
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