ChemSpider 2D Image | Methyl oxazole-2-carboxylate | C5H5NO3

Methyl oxazole-2-carboxylate

  • Molecular FormulaC5H5NO3
  • Average mass127.098 Da
  • Monoisotopic mass127.026939 Da
  • ChemSpider ID28536926

More details:






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

1,3-Oxazole-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
2-Oxazolecarboxylic acid, methyl ester [ACD/Index Name]
31698-88-1 [RN]
Methyl 1,3-oxazole-2-carboxylate [ACD/IUPAC Name]
Methyl oxazole-2-carboxylate
Methyl-1,3-oxazol-2-carboxylat [German] [ACD/IUPAC Name]
[31698-88-1] [RN]
AGN-PC-09TAJX
AKOS006285624
DS-2740
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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: 177.2±23.0 °C at 760 mmHg
    Vapour Pressure: 1.1±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 41.3±3.0 kJ/mol
    Flash Point: 61.0±22.6 °C
    Index of Refraction: 1.462
    Molar Refractivity: 28.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.24
    ACD/LogD (pH 5.5): 0.40
    ACD/BCF (pH 5.5): 1.18
    ACD/KOC (pH 5.5): 39.29
    ACD/LogD (pH 7.4): 0.40
    ACD/BCF (pH 7.4): 1.18
    ACD/KOC (pH 7.4): 39.29
    Polar Surface Area: 52 Å2
    Polarizability: 11.3±0.5 10-24cm3
    Surface Tension: 40.2±3.0 dyne/cm
    Molar Volume: 103.3±3.0 cm3

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