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CAS 25115-74-6

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4-Oxo-1-phenylcyclohexanecarbonitrile

Description:
4-Oxo-1-phenylcyclohexanecarbonitrile, with the CAS number 25115-74-6, is an organic compound characterized by its cyclohexane ring structure, which is substituted with a phenyl group and a carbonitrile functional group. The presence of the carbonitrile (-C≡N) group indicates that it has potential applications in organic synthesis and as a building block in pharmaceuticals. The ketone functional group (4-oxo) contributes to its reactivity, making it a versatile intermediate in various chemical reactions. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure suggests that it may participate in nucleophilic addition reactions due to the electrophilic nature of the carbonyl carbon. Additionally, the phenyl group can influence the compound's electronic properties and stability. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper precautions are taken. Overall, 4-Oxo-1-phenylcyclohexanecarbonitrile is of interest in synthetic organic chemistry and material science.
Formula:C13H13NO
InChI:InChI=1S/C13H13NO/c14-10-13(8-6-12(15)7-9-13)11-4-2-1-3-5-11/h1-5H,6-9H2
InChI key:InChIKey=GKXOABVSZWCJJK-UHFFFAOYSA-N
SMILES:C(#N)C1(CCC(=O)CC1)C2=CC=CC=C2
Synonyms:
  • 4-Oxo-1-Phenylcyclohexanecarbonitrile
  • 4-Oxo-1-Phenylcyclohexanenitrile
  • 4-Oxo-1-phenylcyclohexane-1-carbonitrile
  • 4-Phenyl-4-cyanocyclohexan-1-one
  • 4-Phenyl-4-cyanocyclohexanone
  • Cyclohexanecarbonitrile, 4-oxo-1-phenyl-
  • 4-Cyano-4-phenylcyclohexanone
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