ChemSpider 2D Image | 5-Oxo-1-[4-(propoxycarbonyl)phenyl]-3-pyrrolidinecarboxylic acid | C15H17NO5

5-Oxo-1-[4-(propoxycarbonyl)phenyl]-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC15H17NO5
  • Average mass291.299 Da
  • Monoisotopic mass291.110687 Da
  • ChemSpider ID23078834

More details:






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

3-Pyrrolidinecarboxylic acid, 5-oxo-1-[4-(propoxycarbonyl)phenyl]- [ACD/Index Name]
5-Oxo-1-[4-(propoxycarbonyl)phenyl]-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
5-Oxo-1-[4-(propoxycarbonyl)phenyl]-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
5-oxo-1-[4-(propoxycarbonyl)phenyl]pyrrolidine-3-carboxylic acid
Acide 5-oxo-1-[4-(propoxycarbonyl)phényl]-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
3-pyrrolidinecarboxylic acid, 5-oxo-1-[4-(propoxycarbonyl)phenyl]
5-Oxo-1-(4-(propoxycarbonyl)phenyl)pyrrolidine-3-carboxylic acid
5-oxo-1-(4-propoxycarbonylphenyl)pyrrolidine-3-carboxylic acid
5-Oxo-1-(4-propoxycarbonyl-phenyl)-pyrrolidine-3-carboxylic acid
899762-52-8 [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 572.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.3±3.0 kJ/mol
    Flash Point: 300.1±28.7 °C
    Index of Refraction: 1.573
    Molar Refractivity: 73.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.77
    ACD/LogD (pH 5.5): 0.39
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 10.23
    ACD/LogD (pH 7.4): -1.39
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 84 Å2
    Polarizability: 29.2±0.5 10-24cm3
    Surface Tension: 55.4±3.0 dyne/cm
    Molar Volume: 223.6±3.0 cm3

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