ChemSpider 2D Image | 1-methyl-5-nitropyrazole-3-carboxamide | C5H6N4O3

1-methyl-5-nitropyrazole-3-carboxamide

  • Molecular FormulaC5H6N4O3
  • Average mass170.126 Da
  • Monoisotopic mass170.043991 Da
  • ChemSpider ID26520631

More details:

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

1245771-73-6 [RN]
1H-Pyrazole-3-carboxamide, 1-methyl-5-nitro- [ACD/Index Name]
1-Methyl-5-nitro-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-Methyl-5-nitro-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-Méthyl-5-nitro-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1-methyl-5-nitropyrazole-3-carboxamide
1-methyl-5-nitro-pyrazole-3-carboxamide
AGN-PC-08VYLA
AKOS005169636
MCULE-6762973994
More...

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 364.4±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.1±3.0 kJ/mol
    Flash Point: 174.2±22.3 °C
    Index of Refraction: 1.705
    Molar Refractivity: 38.3±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -1.41
    ACD/LogD (pH 5.5): -0.75
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 9.34
    ACD/LogD (pH 7.4): -0.75
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 9.34
    Polar Surface Area: 107 Å2
    Polarizability: 15.2±0.5 10-24cm3
    Surface Tension: 82.7±7.0 dyne/cm
    Molar Volume: 98.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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