ChemSpider 2D Image | tert-Butyl 5-oxo-2-azaspiro[3.3]heptane-2-carboxylate | C11H17NO3

tert-Butyl 5-oxo-2-azaspiro[3.3]heptane-2-carboxylate

  • Molecular FormulaC11H17NO3
  • Average mass211.258 Da
  • Monoisotopic mass211.120850 Da
  • ChemSpider ID26232100

More details:

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

1251020-88-8 [RN]
2-Azaspiro[3.3]heptane-2-carboxylic acid, 5-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 5-oxo-2-azaspiro[3.3]heptane-2-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5-oxo-2-azaspiro[3.3]heptan-2-carboxylat [German] [ACD/IUPAC Name]
5-Oxo-2-azaspiro[3.3]heptane-2-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
MFCD17016196 [MDL number]
tert-Butyl 5-oxo-2-azaspiro[3.3]heptane-2-carboxylate
[1251020-88-8] [RN]
1094073-72-9 [RN]
125102-08-1 [RN]
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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: 314.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.6±3.0 kJ/mol
    Flash Point: 144.1±25.9 °C
    Index of Refraction: 1.518
    Molar Refractivity: 54.8±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.20
    ACD/LogD (pH 5.5): 0.50
    ACD/BCF (pH 5.5): 1.41
    ACD/KOC (pH 5.5): 44.50
    ACD/LogD (pH 7.4): 0.50
    ACD/BCF (pH 7.4): 1.41
    ACD/KOC (pH 7.4): 44.50
    Polar Surface Area: 47 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 42.4±5.0 dyne/cm
    Molar Volume: 180.8±5.0 cm3

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