ChemSpider 2D Image | Methyl 1-acetyl-4-oxo-3-piperidinecarboxylate | C9H13NO4

Methyl 1-acetyl-4-oxo-3-piperidinecarboxylate

  • Molecular FormulaC9H13NO4
  • Average mass199.204 Da
  • Monoisotopic mass199.084457 Da
  • ChemSpider ID28291145

More details:

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

17038-83-4 [RN]
1-Acétyl-4-oxo-3-pipéridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-Piperidinecarboxylic acid, 1-acetyl-4-oxo-, methyl ester [ACD/Index Name]
Methyl 1-acetyl-4-oxo-3-piperidinecarboxylate [ACD/IUPAC Name]
Methyl 1-acetyl-4-oxopiperidine-3-carboxylate
Methyl-1-acetyl-4-oxo-3-piperidincarboxylat [German] [ACD/IUPAC Name]
1-acetyl-4-oxo-3-piperidinecarboxylic acid methyl ester
1-Acetyl-4-oxo-3-piperidinecarboxylicacidmethylester
1-Acetyl-4-oxonipecotic acid methyl ester
MFCD22576169 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 287.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.7±3.0 kJ/mol
    Flash Point: 127.6±25.9 °C
    Index of Refraction: 1.488
    Molar Refractivity: 46.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.77
    ACD/LogD (pH 5.5): -0.45
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 13.51
    ACD/LogD (pH 7.4): -0.45
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 13.49
    Polar Surface Area: 64 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 44.7±3.0 dyne/cm
    Molar Volume: 162.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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