ChemSpider 2D Image | 1-(4-Cyanophenyl)-1H-pyrazole-3-carboxylic acid | C11H7N3O2

1-(4-Cyanophenyl)-1H-pyrazole-3-carboxylic acid

  • Molecular FormulaC11H7N3O2
  • Average mass213.192 Da
  • Monoisotopic mass213.053833 Da
  • ChemSpider ID24800067

More details:

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

1-(4-Cyanophenyl)-1H-pyrazole-3-carboxylic acid [ACD/IUPAC Name]
1-(4-Cyanphenyl)-1H-pyrazol-3-carbonsäure [German] [ACD/IUPAC Name]
1239742-64-3 [RN]
1H-Pyrazole-3-carboxylic acid, 1-(4-cyanophenyl)- [ACD/Index Name]
Acide 1-(4-cyanophényl)-1H-pyrazole-3-carboxylique [French] [ACD/IUPAC Name]
1-(4-Cyano-phenyl)-1H-pyrazole-3-carboxylic acid
1-(4-Cyano-phenyl)-1H-pyrazole-3-carboxylic acid
1-(4-cyanophenyl)pyrazole-3-carboxylic acid
AGN-PC-0FSQJ1
AKOS013773286
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 455.5±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.4±3.0 kJ/mol
    Flash Point: 229.3±23.2 °C
    Index of Refraction: 1.658
    Molar Refractivity: 58.8±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.03
    ACD/LogD (pH 5.5): -0.06
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.60
    ACD/LogD (pH 7.4): -1.36
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 79 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 58.8±7.0 dyne/cm
    Molar Volume: 159.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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