ChemSpider 2D Image | (S)-methyl 6-oxopiperazine-2-carboxylate | C6H10N2O3

(S)-methyl 6-oxopiperazine-2-carboxylate

  • Molecular FormulaC6H10N2O3
  • Average mass158.155 Da
  • Monoisotopic mass158.069138 Da
  • ChemSpider ID24188215

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-6-Oxo-2-pipérazinecarboxylate de méthyle [French] [ACD/IUPAC Name]
(S)-methyl 6-oxopiperazine-2-carboxylate
234109-21-8 [RN]
2-Piperazinecarboxylic acid, 6-oxo-, methyl ester, (2S)- [ACD/Index Name]
Methyl (2S)-6-oxo-2-piperazinecarboxylate [ACD/IUPAC Name]
Methyl-(2S)-6-oxo-2-piperazincarboxylat [German] [ACD/IUPAC Name]
(S)-Methyl 6-Oxopiperazine-2-Carboxylate (en)
2-Piperazinecarboxylic acid, 6-oxo-, methyl ester, (2S)- (9CI)
2-Piperazinecarboxylic acid,6-oxo-,methyl ester,(2S)-
2-Piperazinecarboxylicacid,6-oxo-,methylester,(2S)-(9CI)
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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: 348.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.3±3.0 kJ/mol
    Flash Point: 164.4±27.9 °C
    Index of Refraction: 1.459
    Molar Refractivity: 36.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -2.02
    ACD/LogD (pH 5.5): -2.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.58
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.11
    Polar Surface Area: 67 Å2
    Polarizability: 14.4±0.5 10-24cm3
    Surface Tension: 36.4±3.0 dyne/cm
    Molar Volume: 132.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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