ChemSpider 2D Image | 3-(Aminomethyl)-1,2,4-oxadiazole-5-carboxamide | C4H6N4O2

3-(Aminomethyl)-1,2,4-oxadiazole-5-carboxamide

  • Molecular FormulaC4H6N4O2
  • Average mass142.116 Da
  • Monoisotopic mass142.049072 Da
  • ChemSpider ID23041496

More details:

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

1,2,4-Oxadiazole-5-carboxamide, 3-(aminomethyl)- [ACD/Index Name]
1211735-02-2 [RN]
3-(Aminomethyl)-1,2,4-oxadiazol-5-carboxamid [German] [ACD/IUPAC Name]
3-(Aminomethyl)-1,2,4-oxadiazole-5-carboxamide [ACD/IUPAC Name]
3-(Aminométhyl)-1,2,4-oxadiazole-5-carboxamide [French] [ACD/IUPAC Name]
1,2,4-oxadiazole-5-carboxamide, 3-(aminomethyl)
MFCD12198493 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 342.6±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.6±3.0 kJ/mol
    Flash Point: 161.0±28.4 °C
    Index of Refraction: 1.574
    Molar Refractivity: 32.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 4
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -1.87
    ACD/LogD (pH 5.5): -2.14
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.25
    ACD/LogD (pH 7.4): -1.89
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.22
    Polar Surface Area: 108 Å2
    Polarizability: 12.7±0.5 10-24cm3
    Surface Tension: 78.5±3.0 dyne/cm
    Molar Volume: 97.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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