ChemSpider 2D Image | 3-N-Boc-aminocyclohexanone | C11H19NO3

3-N-Boc-aminocyclohexanone

  • Molecular FormulaC11H19NO3
  • Average mass213.273 Da
  • Monoisotopic mass213.136490 Da
  • ChemSpider ID22568271

More details:

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

(3-Oxocyclohexyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1,1-Dimethylethyl N-(3-oxocyclohexyl)carbamate
2-Methyl-2-propanyl (3-oxocyclohexyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3-oxocyclohexyl)carbamat [German] [ACD/IUPAC Name]
3-N-Boc-aminocyclohexanone
885280-38-6 [RN]
Carbamic acid, N-(3-oxocyclohexyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
(3-oxo-cyclohexyl)-carbamic acid tert-butyl ester
(3-Oxocyclohexyl)carbamic acid tert-butyl ester
(3-Oxocyclohexyl)-carbamic acid, 1,1-dimethylethyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 335.9±31.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.9±3.0 kJ/mol
    Flash Point: 157.0±24.8 °C
    Index of Refraction: 1.475
    Molar Refractivity: 56.5±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.03
    ACD/LogD (pH 5.5): 1.24
    ACD/BCF (pH 5.5): 5.16
    ACD/KOC (pH 5.5): 112.66
    ACD/LogD (pH 7.4): 1.24
    ACD/BCF (pH 7.4): 5.16
    ACD/KOC (pH 7.4): 112.66
    Polar Surface Area: 55 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 36.6±5.0 dyne/cm
    Molar Volume: 200.9±5.0 cm3

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