ChemSpider 2D Image | 4-Bromo-3-phenyl-1H-pyrazole-5-carboxylic acid | C10H7BrN2O2

4-Bromo-3-phenyl-1H-pyrazole-5-carboxylic acid

  • Molecular FormulaC10H7BrN2O2
  • Average mass267.079 Da
  • Monoisotopic mass265.969086 Da
  • ChemSpider ID23362655

More details:

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

1H-Pyrazole-5-carboxylic acid, 4-bromo-3-phenyl- [ACD/Index Name]
4-Brom-3-phenyl-1H-pyrazol-5-carbonsäure [German] [ACD/IUPAC Name]
4-Bromo-3-phenyl-1H-pyrazole-5-carboxylic acid [ACD/IUPAC Name]
Acide 4-bromo-3-phényl-1H-pyrazole-5-carboxylique [French] [ACD/IUPAC Name]
1238384-46-7 [RN]
4-bromo-3-phenylpyrazole-5-carboxylic acid
4-bromo-5-phenyl-1H-pyrazole-3-carboxylic acid
4-Bromo-5-phenyl-2H-pyrazole-3-carboxylic acid
AC1Q721N
BBL032563
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: 493.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.1±3.0 kJ/mol
    Flash Point: 252.3±28.7 °C
    Index of Refraction: 1.671
    Molar Refractivity: 58.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.29
    ACD/LogD (pH 5.5): -0.19
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.27
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 66 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 69.2±3.0 dyne/cm
    Molar Volume: 155.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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