ChemSpider 2D Image | Methyl (3S)-5-oxo-3-pyrrolidinecarboxylate | C6H9NO3

Methyl (3S)-5-oxo-3-pyrrolidinecarboxylate

  • Molecular FormulaC6H9NO3
  • Average mass143.141 Da
  • Monoisotopic mass143.058243 Da
  • ChemSpider ID24203370

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-5-Oxo-3-pyrrolidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 5-oxo-, methyl ester, (3S)- [ACD/Index Name]
Methyl (3S)-5-oxo-3-pyrrolidinecarboxylate [ACD/IUPAC Name]
Methyl-(3S)-5-oxo-3-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
(S)-methyl 5-oxopyrrolidine-3-carboxylate
(s)-methyl 5-oxopyrrolidine-3-carboxylate(wxc01688)
3-Pyrrolidinecarboxylic acid, 5-oxo-, methyl ester, (3S)- (9CI)
428518-31-4 [RN]
methyl (3S)-5-oxopyrrolidine-3-carboxylate
methyl (S)-5-oxopyrrolidine-3-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 304.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.5±3.0 kJ/mol
    Flash Point: 138.1±25.9 °C
    Index of Refraction: 1.465
    Molar Refractivity: 32.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -1.65
    ACD/LogD (pH 5.5): -0.90
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 7.73
    ACD/LogD (pH 7.4): -0.90
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 7.73
    Polar Surface Area: 55 Å2
    Polarizability: 13.0±0.5 10-24cm3
    Surface Tension: 39.3±3.0 dyne/cm
    Molar Volume: 118.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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