ChemSpider 2D Image | 3-amino-1-(tert-butoxycarbonyl)azetidine-3-carboxylic acid | C9H16N2O4

3-amino-1-(tert-butoxycarbonyl)azetidine-3-carboxylic acid

  • Molecular FormulaC9H16N2O4
  • Average mass216.234 Da
  • Monoisotopic mass216.111008 Da
  • ChemSpider ID26549056

More details:

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

1,3-Azetidinedicarboxylic acid, 3-amino-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
1262412-13-4 [RN]
3-amino-1-(tert-butoxycarbonyl)azetidine-3-carboxylic acid
3-Amino-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidincarbonsäure [German] [ACD/IUPAC Name]
3-Amino-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid [ACD/IUPAC Name]
Acide 3-amino-1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-azétidinecarboxylique [French] [ACD/IUPAC Name]
1-Boc-3-amino-3-azetidinecarboxylic acid
3-amino-1-(tert-butoxycarbonyl)-3-azetidinecarboxylic acid
3-amino-1-[(tert-butoxy)carbonyl]azetidine-3-carboxylic acid
Chemistry 17999
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 350.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 65.3±6.0 kJ/mol
    Flash Point: 165.6±27.9 °C
    Index of Refraction: 1.531
    Molar Refractivity: 51.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.05
    ACD/LogD (pH 5.5): -2.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.72
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 93 Å2
    Polarizability: 20.5±0.5 10-24cm3
    Surface Tension: 55.6±3.0 dyne/cm
    Molar Volume: 167.5±3.0 cm3

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