ChemSpider 2D Image | 2-Methyl-2-propanyl 1-benzyl-3-pyrrolidinecarboxylate | C16H23NO2

2-Methyl-2-propanyl 1-benzyl-3-pyrrolidinecarboxylate

  • Molecular FormulaC16H23NO2
  • Average mass261.359 Da
  • Monoisotopic mass261.172882 Da
  • ChemSpider ID26511339

More details:






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

1-Benzyl-3-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 1-benzyl-3-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-1-benzyl-3-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-(phenylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
131878-23-4 [RN]
155110-03-5 [RN]
MFCD07782180 [MDL number]
MFCD13195123 [MDL number]
tert-Butyl 1-Benzylpyrrolidine-3-carboxylate
tert-Butyl 1-Benzylpyrrolidine-3-carboxylate?

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.1±0.1 g/cm3
    Boiling Point: 331.2±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.4±3.0 kJ/mol
    Flash Point: 106.5±16.8 °C
    Index of Refraction: 1.532
    Molar Refractivity: 76.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.01
    ACD/LogD (pH 5.5): 0.66
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.37
    ACD/LogD (pH 7.4): 2.33
    ACD/BCF (pH 7.4): 20.02
    ACD/KOC (pH 7.4): 156.22
    Polar Surface Area: 30 Å2
    Polarizability: 30.1±0.5 10-24cm3
    Surface Tension: 41.1±3.0 dyne/cm
    Molar Volume: 245.3±3.0 cm3

    Click to predict properties on the Chemicalize site






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