ChemSpider 2D Image | benzyl (S)-(1-(butylamino)-3-methyl-1-oxobutan-2-yl)carbamate | C17H26N2O3

benzyl (S)-(1-(butylamino)-3-methyl-1-oxobutan-2-yl)carbamate

  • Molecular FormulaC17H26N2O3
  • Average mass306.400 Da
  • Monoisotopic mass306.194336 Da
  • ChemSpider ID28536777

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2S)-1-(Butylamino)-3-méthyl-1-oxo-2-butanyl]carbamate de benzyle [French] [ACD/IUPAC Name]
219323-42-9 [RN]
benzyl (S)-(1-(butylamino)-3-methyl-1-oxobutan-2-yl)carbamate
Benzyl [(2S)-1-(butylamino)-3-methyl-1-oxo-2-butanyl]carbamate [ACD/IUPAC Name]
Benzyl-[(2S)-1-(butylamino)-3-methyl-1-oxo-2-butanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1S)-1-[(butylamino)carbonyl]-2-methylpropyl]-, phenylmethyl ester [ACD/Index Name]
Phenylmethyl N-[(1S)-1-[(butylamino)carbonyl]-2-methylpropyl]carbamate
(S)-Benzyl (1-(butylamino)-3-methyl-1-oxobutan-2-yl)carbamate
(S)-Benzyl(1-(butylamino)-3-methyl-1-oxobutan-2-yl)carbamate
(S)-BENZYL-(1-(BUTYLAMINO)-3-METHYL-1-OXOBUTAN-2-YL)CARBAMATE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 497.3±38.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.5±3.0 kJ/mol
    Flash Point: 254.6±26.8 °C
    Index of Refraction: 1.508
    Molar Refractivity: 86.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 3.42
    ACD/LogD (pH 5.5): 2.96
    ACD/BCF (pH 5.5): 105.22
    ACD/KOC (pH 5.5): 975.07
    ACD/LogD (pH 7.4): 2.96
    ACD/BCF (pH 7.4): 105.19
    ACD/KOC (pH 7.4): 974.73
    Polar Surface Area: 67 Å2
    Polarizability: 34.3±0.5 10-24cm3
    Surface Tension: 38.6±3.0 dyne/cm
    Molar Volume: 289.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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