ChemSpider 2D Image | 1,5-Diphenyl-1H-pyrazole-3-carbaldehyde | C16H12N2O

1,5-Diphenyl-1H-pyrazole-3-carbaldehyde

  • Molecular FormulaC16H12N2O
  • Average mass248.279 Da
  • Monoisotopic mass248.094955 Da
  • ChemSpider ID28671645

More details:






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

1,5-Diphenyl-1H-pyrazol-3-carbaldehyd [German] [ACD/IUPAC Name]
1,5-Diphenyl-1H-pyrazole-3-carbaldehyde [ACD/IUPAC Name]
1,5-Diphényl-1H-pyrazole-3-carbaldéhyde [French] [ACD/IUPAC Name]
112009-28-6 [RN]
1H-Pyrazole-3-carboxaldehyde, 1,5-diphenyl- [ACD/Index Name]
[112009-28-6] [RN]
1,5-diphenylpyrazole-3-carbaldehyde
1H-Pyrazole-3-carboxaldehyde,1,5-diphenyl-
MFCD04115088
QB-4194

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 441.3±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.9±3.0 kJ/mol
    Flash Point: 220.7±25.4 °C
    Index of Refraction: 1.621
    Molar Refractivity: 76.5±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.49
    ACD/LogD (pH 5.5): 3.48
    ACD/BCF (pH 5.5): 259.30
    ACD/KOC (pH 5.5): 1859.53
    ACD/LogD (pH 7.4): 3.48
    ACD/BCF (pH 7.4): 259.30
    ACD/KOC (pH 7.4): 1859.53
    Polar Surface Area: 35 Å2
    Polarizability: 30.3±0.5 10-24cm3
    Surface Tension: 46.3±7.0 dyne/cm
    Molar Volume: 217.4±7.0 cm3

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