Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo-

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Names

[ CAS No. ]:
7027-11-4

[ Name ]:
Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo-

[Synonym ]:
5-Oxo-1,3,3-trimethylcyclohexanecarbonitrile
3-Cyano-3,5,5-trimethylcyclohexanone
Cychohexanecarbonitrile,1,3,3-trimethyl-5-oxo
3,3,5-Trimethyl-5-cyanocyclohexanone
Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo
isophoronenitrile
1,3,3-trimethyl-5-oxo-cyclohexane-carbonitrile
cyano-3 trimethyl-3,5,5 cyclohexanone

Chemical & Physical Properties

[ Density]:
1.53g/cm3

[ Boiling Point ]:
677.2ºC at 760 mmHg

[ Molecular Formula ]:
C10H15NO

[ Molecular Weight ]:
165.23200

[ Flash Point ]:
363.3ºC

[ Exact Mass ]:
165.11500

[ PSA ]:
40.86000

[ LogP ]:
2.29548

[ Index of Refraction ]:
1.701

Safety Information

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
22-43-48/22-52/53

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Isophorone
  • HYDROGEN CYANIDE
  • Phosphoric acid
  • (Cyano-κC)(diethyl)aluminium
  • POTASSIUM CYANIDE
  • N,N,N-Triethylethanaminium cyanide
  • 3-cyano-3,5,5-trimethyl cyclohexane
  • Tetrapropylammonium bromide

DownStream

  • Isophorone diamine
  • 3-(aminomethyl)-3,5,5-trimethylcyclohexanamine
  • 3-aminomethyl-3,5,5-trimethylcyclohexan-1-ol
  • 5-imino-1,3,3-trimethylcyclohexane-1-carbonitrile
  • 1,3,3-Trimethyl-5-oxocyclohexanecarboxylic acid
  • (1,3,3-triMethylcyclohexyl)MethanaMine

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • (+/-)-(1RS,2SR)-2-<2-(2-methoxyphenyl)-ethyl>-1,3,3-trimethyl-5-oxocyclohexanecarbonitrile
  • Methoxy-phenyl-(1,3,3-trimethyl-5-oxo-cyclohexyl)-acetonitrile
  • 3-methoxycarbonyl-3,5,5-trimethylcyclohexanone
  • diethyl 3-phosphono-3,5,5-trimethylcyclohexanone
  • oxydiethylene bis[[[1,3,3-trimethyl-5-[[(2-methyl-6-oxo-1-piperidyl)carbonyl]amino]cyclohexyl]methyl]carbamate]
  • methyl 2-(p-methoxybenzyl)-4-oxo-1,3,3-trimethyl-5-piperidinecarboxylate hydrochloride
  • Ethyl 2-(6-chloropyridine-3-amido)-4,5-dimethylthiophene-3-carboxylate
  • (E)-methyl 2-[phthalimidooxymethylphenyl]-3-methoxypropenoate
  • (E)-Methyl 2-(2-((aminooxy)methyl)phenyl)-3-methoxyacrylate
  • 3,6-dichloro-N-(2,4-dichlorophenyl)pyridine-2-carboxamide
  • 3,6-dichloro-N-(quinolin-8-yl)pyridine-2-carboxamide
  • (1R,2S)-cyclohexane-1,2-dithiol
  • 3,6-dichloro-N-(2,6-diethylphenyl)pyridine-2-carboxamide
  • 2-(azetidin-2-yl)-1H-imidazole
  • 3-{3-bromo-4-[(dimethylcarbamoyl)methoxy]-5-methoxyphenyl}-2-cyano-N-cyclohexylprop-2-enamide
  • (2R)-2-Amino-3-methyl-3-[(trifluoromethyl)sulfanyl]butanoic acid
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