2-NITROCYCLOHEXANONE

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Names

[ CAS No. ]:
4883-67-4

[ Name ]:
2-NITROCYCLOHEXANONE

[Synonym ]:
Cyclohexanone,2-nitro
MFCD00001627
2-Nitrocyclohexanone
2-nitro-cyclohexan-1-one
2-Nitro-cyclohexanon
Cyclohexanone, 2-nitro-

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
272.7±29.0 °C at 760 mmHg

[ Melting Point ]:
39-43ºC(lit.)

[ Molecular Formula ]:
C6H9NO3

[ Molecular Weight ]:
143.141

[ Flash Point ]:
135.6±17.1 °C

[ Exact Mass ]:
143.058243

[ PSA ]:
62.89000

[ LogP ]:
0.17

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.480

MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H319

[ Precautionary Statements ]:
P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R22;R36

[ Safety Phrases ]:
S26

[ RIDADR ]:
NONH for all modes of transport

[ HS Code ]:
2914700090

Synthetic Route

Precursor & DownStream

Precursor

  • 1-cyclohexenyl acetate
  • Cyclohexene
  • 1-(trimethylsilyloxy)-cyclohex-1-ene
  • Cyclohexanone
  • tetranitromethane
  • 2-Nitro-cyclohexylacetat
  • 2-nitrocyclohex-1-enol
  • 2-nitrocyclohexanol

DownStream

  • 6-Nitrohexanoic acid
  • Glutaric acid
  • Adipic acid
  • 1-nitrocyclohex-1-ene
  • 2-nitrocyclohexanol
  • monomethyl adipate
  • Dimethyl adipate
  • Isopropyl adipate
  • Methyl 6-oxohexanoate
  • 1,1-dimethyl-2-(2-nitrocyclohexyl)hydrazine

Customs

[ HS Code ]: 2914700090

[ Summary ]:
HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

Articles

Solvent effects on the rate of the keto-enol interconversion of 2-nitrocyclohexanone.

Org. Biomol. Chem. 6(22) , 4236-41, (2008)

The rates of tautomerization of 2-nitrocyclohexanone (2-NCH) have been measured spectrophotometrically at 25.0 +/- 0.1 degrees C in several organic aprotic solvents and their binary mixtures. In cyclo...


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Related Compounds

  • 2-methyl-2-nitrocyclohexanone
  • 4-t-Butyl-2-nitrocyclohexanone
  • cis-6-methyl-2-nitrocyclohexanone
  • 2-Nitrocyclohexanone tosylhydrazone
  • trans-6-methyl-2-nitrocyclohexanone
  • 2-(2-Chlorophenyl)-2-nitrocyclohexanone