ChemSpider 2D Image | Benzyl [(2S)-3-methyl-1-(methylamino)-1-oxo-2-butanyl]carbamate | C14H20N2O3

Benzyl [(2S)-3-methyl-1-(methylamino)-1-oxo-2-butanyl]carbamate

  • Molecular FormulaC14H20N2O3
  • Average mass264.320 Da
  • Monoisotopic mass264.147400 Da
  • ChemSpider ID28295374

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2S)-3-Méthyl-1-(méthylamino)-1-oxo-2-butanyl]carbamate de benzyle [French] [ACD/IUPAC Name]
Benzyl [(2S)-3-methyl-1-(methylamino)-1-oxo-2-butanyl]carbamate [ACD/IUPAC Name]
Benzyl-[(2S)-3-methyl-1-(methylamino)-1-oxo-2-butanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1S)-2-methyl-1-[(methylamino)carbonyl]propyl]-, phenylmethyl ester [ACD/Index Name]
(S)-Benzyl (3-methyl-1-(methylamino)-1-oxobutan-2-yl)carbamate
(S)-Benzyl(3-methyl-1-(methylamino)-1-oxobutan-2-yl)carbamate
(S)-BENZYL-(3-METHYL-1-(METHYLAMINO)-1-OXOBUTAN-2-YL)CARBAMATE
128647-50-7 [RN]
Benzyl [(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamate
BENZYL N-[(1S)-2-METHYL-1-(METHYLCARBAMOYL)PROPYL]CARBAMATE
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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: 468.0±38.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.0±3.0 kJ/mol
    Flash Point: 236.8±26.8 °C
    Index of Refraction: 1.515
    Molar Refractivity: 72.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.83
    ACD/LogD (pH 5.5): 1.74
    ACD/BCF (pH 5.5): 12.42
    ACD/KOC (pH 5.5): 211.25
    ACD/LogD (pH 7.4): 1.74
    ACD/BCF (pH 7.4): 12.41
    ACD/KOC (pH 7.4): 211.13
    Polar Surface Area: 67 Å2
    Polarizability: 28.7±0.5 10-24cm3
    Surface Tension: 39.7±3.0 dyne/cm
    Molar Volume: 240.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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