ChemSpider 2D Image | tert-butyl 5-oxo-4,7-diazaspiro[2.5]octane-7-carboxylate | C11H18N2O3

tert-butyl 5-oxo-4,7-diazaspiro[2.5]octane-7-carboxylate

  • Molecular FormulaC11H18N2O3
  • Average mass226.272 Da
  • Monoisotopic mass226.131744 Da
  • ChemSpider ID26457448

More details:

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

1199794-51-8 [RN]
2-Methyl-2-propanyl 5-oxo-4,7-diazaspiro[2.5]octane-7-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5-oxo-4,7-diazaspiro[2.5]octan-7-carboxylat [German] [ACD/IUPAC Name]
4,7-Diazaspiro[2.5]octane-7-carboxylic acid, 5-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
5-Oxo-4,7-diazaspiro[2.5]octane-7-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 5-oxo-4,7-diazaspiro[2.5]octane-7-carboxylate
[1199794-51-8] [RN]
5-oxo-4,7-diaza-spiro[2.5]octane-7-carboxylic acid tert-butyl ester
5-Oxo-4,7-diaza-spiro2.5octane-7-carboxylic acid tert-butyl ester
MFCD18064603 [MDL number]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 399.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.0±3.0 kJ/mol
    Flash Point: 195.2±25.9 °C
    Index of Refraction: 1.532
    Molar Refractivity: 58.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.68
    ACD/LogD (pH 5.5): 0.19
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 30.23
    ACD/LogD (pH 7.4): 0.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 30.23
    Polar Surface Area: 59 Å2
    Polarizability: 23.2±0.5 10-24cm3
    Surface Tension: 45.5±5.0 dyne/cm
    Molar Volume: 188.4±5.0 cm3

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