ChemSpider 2D Image | 1-Boc-3-(cyanomethyl)pyrrolidine | C11H18N2O2

1-Boc-3-(cyanomethyl)pyrrolidine

  • Molecular FormulaC11H18N2O2
  • Average mass210.273 Da
  • Monoisotopic mass210.136826 Da
  • ChemSpider ID23078436

More details:

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

142253-46-1 [RN]
1-Boc-3-(cyanomethyl)pyrrolidine
1-Pyrrolidinecarboxylic acid, 3-(cyanomethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-(cyanomethyl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(cyanmethyl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-(Cyanométhyl)-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 3-(cyanomethyl)pyrrolidine-1-carboxylate
tert-Butyl-3-(cyanmethyl)pyrrolidin-1-carboxylat
[142253-46-1] [RN]
1,4-Dimethyl-9H-carbazole [ACD/IUPAC Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 327.4±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.0±3.0 kJ/mol
    Flash Point: 151.8±20.4 °C
    Index of Refraction: 1.478
    Molar Refractivity: 56.1±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.72
    ACD/LogD (pH 5.5): 1.27
    ACD/BCF (pH 5.5): 5.42
    ACD/KOC (pH 5.5): 116.65
    ACD/LogD (pH 7.4): 1.27
    ACD/BCF (pH 7.4): 5.42
    ACD/KOC (pH 7.4): 116.65
    Polar Surface Area: 53 Å2
    Polarizability: 22.2±0.5 10-24cm3
    Surface Tension: 39.6±3.0 dyne/cm
    Molar Volume: 197.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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