ChemSpider 2D Image | 1-Benzyl-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-pyrrolidinecarboxylic acid | C17H24N2O4

1-Benzyl-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC17H24N2O4
  • Average mass320.384 Da
  • Monoisotopic mass320.173615 Da
  • ChemSpider ID23346593

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

[1027511-74-5] [RN]
1027511-74-5 [RN]
1-Benzyl-3-((tert-butoxycarbonyl)amino)pyrrolidine-3-carboxylic acid
1-Benzyl-3-(Boc-amino)pyrrolidine-3-carboxylic Acid
1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine-3-carboxylic acid
1-benzyl-3-(tert-butoxycarbonylamino)pyrrolidine-3-carboxylicacid
1-benzyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-3-carboxylic acid
1-Benzyl-3-[(tert-butoxycarbonyl)amino]pyrrolidine-3-carboxylic acid
1-benzyl-3-{[(tert-butoxy)carbonyl]amino}pyrrolidine-3-carboxylic acid
3-Boc-amino-1-benzylpyrrolidine-3-carboxylic acid
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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: 1.2±0.1 g/cm3
    Boiling Point: 474.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.7±3.0 kJ/mol
    Flash Point: 240.5±28.7 °C
    Index of Refraction: 1.570
    Molar Refractivity: 86.7±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.75
    ACD/LogD (pH 5.5): -0.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.66
    ACD/LogD (pH 7.4): -0.07
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.51
    Polar Surface Area: 79 Å2
    Polarizability: 34.4±0.5 10-24cm3
    Surface Tension: 52.2±5.0 dyne/cm
    Molar Volume: 264.1±5.0 cm3

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