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CAS 7027-11-4

:

1,3,3-Trimethyl-5-oxocyclohexanecarbonitrile

Description:
1,3,3-Trimethyl-5-oxocyclohexanecarbonitrile, with the CAS number 7027-11-4, is an organic compound characterized by its unique structural features. It contains a cyclohexane ring substituted with three methyl groups and a carbonitrile functional group, along with a ketone group. This compound is typically a colorless to pale yellow liquid or solid, depending on its specific form and purity. It is known for its potential applications in organic synthesis and as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the carbonitrile group contributes to its reactivity, making it useful in nucleophilic addition reactions. Additionally, the compound's structure may influence its physical properties, such as boiling point, solubility, and stability under different conditions. Safety data indicates that, like many organic nitriles, it should be handled with care due to potential toxicity and irritant properties. Overall, 1,3,3-Trimethyl-5-oxocyclohexanecarbonitrile is a valuable compound in synthetic organic chemistry.
Formula:C10H15NO
InChI:InChI=1S/C10H15NO/c1-9(2)4-8(12)5-10(3,6-9)7-11/h4-6H2,1-3H3
InChI key:InChIKey=JJDFVIDVSCYKDS-UHFFFAOYSA-N
SMILES:C(#N)C1(C)CC(C)(C)CC(=O)C1
Synonyms:
  • 1,3,3-Trimethyl-5-Oxocyclohexanecarbonitrile
  • 1,3,3-Trimethyl-5-oxocyclohexane-1-carbonitrile
  • 3,3,5-Trimethyl-5-cyanocyclohexanone
  • 3-(Cyanomethyl)-3,5,5-trimethyl-1-cyclohexanone
  • 3-Oxo-1,5,5-trimethylcyclohexanecarbonitrile
  • 4-{[4-(2-{2-[(2,4-Dichlorophenyl)Methylidene]Hydrazino}-1,3-Thiazol-4-Yl)Phenyl]Sulfonyl}Morpholine
  • 5-Oxo-1,3,3-trimethylcyclohexanecarbonitrile
  • Ai3-37061
  • Cychohexanecarbonitrile, 1,3,3-trimethyl-5-oxo-
  • Cyclohexanecarbonitrile, 1,3,3-trimethyl-5-oxo-
  • See more synonyms
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