ChemSpider 2D Image | 1-Boc-4-cyano-2,2-dimethyl-3-oxopyrrolidine | C12H18N2O3

1-Boc-4-cyano-2,2-dimethyl-3-oxopyrrolidine

  • Molecular FormulaC12H18N2O3
  • Average mass238.283 Da
  • Monoisotopic mass238.131744 Da
  • ChemSpider ID24540474

More details:

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

1-Boc-4-cyano-2,2-dimethyl-3-oxopyrrolidine
1-Pyrrolidinecarboxylic acid, 4-cyano-2,2-dimethyl-3-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-cyano-2,2-dimethyl-3-oxo-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-cyan-2,2-dimethyl-3-oxo-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
4-Cyano-2,2-diméthyl-3-oxo-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
718632-42-9 [RN]
946497-94-5 [RN]
TERT-BUTYL 4-CYANO-2,2-DIMETHYL-3-OXOPYRROLIDINE-1-CARBOXYLATE
[718632-42-9] [RN]
[946497-94-5] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 364.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.0±3.0 kJ/mol
    Flash Point: 173.9±27.9 °C
    Index of Refraction: 1.495
    Molar Refractivity: 61.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.73
    ACD/LogD (pH 5.5):
    ACD/BCF (pH 5.5):
    ACD/KOC (pH 5.5):
    ACD/LogD (pH 7.4):
    ACD/BCF (pH 7.4):
    ACD/KOC (pH 7.4):
    Polar Surface Area: 70 Å2
    Polarizability: 24.3±0.5 10-24cm3
    Surface Tension: 42.9±5.0 dyne/cm
    Molar Volume: 210.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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