ChemSpider 2D Image | 2-Methyl-2-propanyl (trans-4-cyanocyclohexyl)carbamate | C12H20N2O2

2-Methyl-2-propanyl (trans-4-cyanocyclohexyl)carbamate

  • Molecular FormulaC12H20N2O2
  • Average mass224.299 Da
  • Monoisotopic mass224.152481 Da
  • ChemSpider ID24751810

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(trans-4-Cyanocyclohexyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (trans-4-cyanocyclohexyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(trans-4-cyancyclohexyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(trans-4-cyanocyclohexyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
(4-Cyano-cyclohexyl)-carbamic acid tert-butyl ester
473923-79-4 [RN]
873537-32-7 [RN]
Carbamic acid, (trans-4-cyanocyclohexyl)-, 1,1-dimethylethyl ester
MFCD11707221 [MDL number]
tert-Butyl ((1r,4r)-4-cyanocyclohexyl)carbamate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 369.6±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.6±3.0 kJ/mol
Flash Point: 177.3±24.8 °C
Index of Refraction: 1.480
Molar Refractivity: 61.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 28.11
ACD/KOC (pH 5.5): 379.11
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 28.11
ACD/KOC (pH 7.4): 379.11
Polar Surface Area: 62 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 39.0±5.0 dyne/cm
Molar Volume: 214.6±5.0 cm3

Click to predict properties on the Chemicalize site


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