ChemSpider 2D Image | tert-Butyl-{(2S)-1-amino-3-[(3R)-tetrahydro-2H-pyran-3-yl]propan-2-yl}methylcarbamat | C14H28N2O3

tert-Butyl-{(2S)-1-amino-3-[(3R)-tetrahydro-2H-pyran-3-yl]propan-2-yl}methylcarbamat

  • Molecular FormulaC14H28N2O3
  • Average mass272.384 Da
  • Monoisotopic mass272.209991 Da
  • ChemSpider ID23077806

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

{(2S)-1-Amino-3-[(3R)-tétrahydro-2H-pyran-3-yl]-2-propanyl}méthylcarbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1,1-Dimethylethyl N-[(1S)-1-(aminomethyl)-2-[(3R)-tetrahydro-2H-pyran-3-yl]ethyl]-N-methylcarbamate
2-Methyl-2-propanyl {(2S)-1-amino-3-[(3R)-tetrahydro-2H-pyran-3-yl]-2-propanyl}methylcarbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{(2S)-1-amino-3-[(3R)-tetrahydro-2H-pyran-3-yl]-2-propanyl}methylcarbamat [German] [ACD/IUPAC Name]
942145-27-9 [RN]
Carbamic acid, N-[(1S)-1-(aminomethyl)-2-[(3R)-tetrahydro-2H-pyran-3-yl]ethyl]-N-methyl-, 1,1-dimethylethyl ester
Carbamic acid, N-[(1S)-2-amino-1-[[(3R)-tetrahydro-2H-pyran-3-yl]methyl]ethyl]-N-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl ((S)-1-amino-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate
tert-butyl {(2S)-1-amino-3-[(3R)-tetrahydro-2H-pyran-3-yl]propan-2-yl}methylcarbamate
tert-Butyl-{(2S)-1-amino-3-[(3R)-tetrahydro-2H-pyran-3-yl]propan-2-yl}methylcarbamat
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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: 370.2±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.7±3.0 kJ/mol
    Flash Point: 177.7±23.2 °C
    Index of Refraction: 1.480
    Molar Refractivity: 75.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.64
    ACD/LogD (pH 5.5): -0.93
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.71
    ACD/BCF (pH 7.4): 1.15
    ACD/KOC (pH 7.4): 19.45
    Polar Surface Area: 65 Å2
    Polarizability: 29.9±0.5 10-24cm3
    Surface Tension: 38.1±3.0 dyne/cm
    Molar Volume: 265.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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