ChemSpider 2D Image | 6-(tert-butoxycarbonyl)-6-azaspiro[3.4]octane-2-carboxylic acid | C13H21NO4

6-(tert-butoxycarbonyl)-6-azaspiro[3.4]octane-2-carboxylic acid

  • Molecular FormulaC13H21NO4
  • Average mass255.310 Da
  • Monoisotopic mass255.147064 Da
  • ChemSpider ID28290409

More details:

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

1251002-42-2 [RN]
6-(tert-butoxycarbonyl)-6-azaspiro[3.4]octane-2-carboxylic acid
6-[(tert-butoxy)carbonyl]-6-azaspiro[3.4]octane-2-carboxylic acid
6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[3.4]octan-2-carbonsäure [German] [ACD/IUPAC Name]
6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[3.4]octane-2-carboxylic acid [ACD/IUPAC Name]
6-Azaspiro[3.4]octane-2,6-dicarboxylic acid, 6-(1,1-dimethylethyl) ester [ACD/Index Name]
Acide 6-{[(2-méthyl-2-propanyl)oxy]carbonyl}-6-azaspiro[3.4]octane-2-carboxylique [French] [ACD/IUPAC Name]
MFCD17016204 [MDL number]
2-OXETANE METHANAMINE
6-[(2-methylpropan-2-yl)oxycarbonyl]-6-azaspiro[3.4]octane-2-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 392.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 70.4±6.0 kJ/mol
    Flash Point: 190.9±25.9 °C
    Index of Refraction: 1.532
    Molar Refractivity: 65.5±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.17
    ACD/LogD (pH 5.5): 0.61
    ACD/BCF (pH 5.5): 1.07
    ACD/KOC (pH 5.5): 20.91
    ACD/LogD (pH 7.4): -1.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 47.9±5.0 dyne/cm
    Molar Volume: 211.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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