ChemSpider 2D Image | (R)-1-Cbz-pyrrolidine-3-carboxylic acid | C13H15NO4

(R)-1-Cbz-pyrrolidine-3-carboxylic acid

  • Molecular FormulaC13H15NO4
  • Average mass249.262 Da
  • Monoisotopic mass249.100113 Da
  • ChemSpider ID21108458

  • defined stereocentres - 1 of 1 defined stereocentres

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

(3R)-1-[(Benzyloxy)carbonyl]-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
(3R)-1-[(Benzyloxy)carbonyl]-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
(3R)-1-[(Benzyloxy)carbonyl]pyrrolidine-3-carboxylic acid
(R)-1-Cbz-pyrrolidine-3-carboxylic acid
(R)-1-N-Cbz-Pyrrolidine-3-carboxylic acid
1,3-Pyrrolidinedicarboxylic acid, 1-(phenylmethyl) ester, (3R)- [ACD/Index Name]
192214-06-5 [RN]
Acide (3R)-1-[(benzyloxy)carbonyl]-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
(3R)-1-phenylmethoxycarbonylpyrrolidine-3-carboxylic acid
(R)-1-((benzyloxy)carbonyl)pyrrolidine-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: 1.3±0.1 g/cm3
    Boiling Point: 432.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.5±3.0 kJ/mol
    Flash Point: 215.3±28.7 °C
    Index of Refraction: 1.582
    Molar Refractivity: 63.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.27
    ACD/LogD (pH 5.5): 0.77
    ACD/BCF (pH 5.5): 1.26
    ACD/KOC (pH 5.5): 20.32
    ACD/LogD (pH 7.4): -1.03
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 25.2±0.5 10-24cm3
    Surface Tension: 58.6±3.0 dyne/cm
    Molar Volume: 190.3±3.0 cm3

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