ChemSpider 2D Image | 4-Chloro-1-methyl-1H-pyrazole-3-carboxamide | C5H6ClN3O

4-Chloro-1-methyl-1H-pyrazole-3-carboxamide

  • Molecular FormulaC5H6ClN3O
  • Average mass159.574 Da
  • Monoisotopic mass159.019943 Da
  • ChemSpider ID28604696

More details:

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

1429419-11-3 [RN]
1H-Pyrazole-3-carboxamide, 4-chloro-1-methyl- [ACD/Index Name]
4-Chlor-1-methyl-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
4-Chloro-1-methyl-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
4-Chloro-1-méthyl-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid amide
4-chloro-1-methylpyrazole-3-carboxamide
AGN-PC-0HG6KE
AKOS024273239
MCULE-2047279089
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 323.5±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.5±3.0 kJ/mol
    Flash Point: 149.4±23.7 °C
    Index of Refraction: 1.648
    Molar Refractivity: 37.2±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.97
    ACD/LogD (pH 5.5): -0.23
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 17.81
    ACD/LogD (pH 7.4): -0.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 17.81
    Polar Surface Area: 61 Å2
    Polarizability: 14.8±0.5 10-24cm3
    Surface Tension: 56.5±7.0 dyne/cm
    Molar Volume: 102.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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