ChemSpider 2D Image | Ethyl 5-amino-1,2,4-oxadiazole-3-carboxylate | C5H7N3O3

Ethyl 5-amino-1,2,4-oxadiazole-3-carboxylate

  • Molecular FormulaC5H7N3O3
  • Average mass157.127 Da
  • Monoisotopic mass157.048737 Da
  • ChemSpider ID30647511

More details:

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

1,2,4-Oxadiazole-3-carboxylic acid, 5-amino-, ethyl ester [ACD/Index Name]
144167-51-1 [RN]
5-Amino-1,2,4-oxadiazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-amino-1,2,4-oxadiazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-5-amino-1,2,4-oxadiazol-3-carboxylat [German] [ACD/IUPAC Name]
[144167-51-1] [RN]
5-Amino-[1,2,4]oxadiazole-3-carboxylic acid ethyl ester
5-amino-1,2,4oxadiazole-3-carboxylic acid ethyl ester
MFCD16990591

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 289.1±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.8±3.0 kJ/mol
    Flash Point: 128.6±22.6 °C
    Index of Refraction: 1.525
    Molar Refractivity: 35.4±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.14
    ACD/LogD (pH 5.5): -0.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 18.43
    ACD/LogD (pH 7.4): -0.20
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 18.43
    Polar Surface Area: 91 Å2
    Polarizability: 14.0±0.5 10-24cm3
    Surface Tension: 59.2±3.0 dyne/cm
    Molar Volume: 115.4±3.0 cm3

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