ChemSpider 2D Image | 4-Bromo-1H-imidazole-2-carbaldehyde | C4H3BrN2O

4-Bromo-1H-imidazole-2-carbaldehyde

  • Molecular FormulaC4H3BrN2O
  • Average mass174.983 Da
  • Monoisotopic mass173.942871 Da
  • ChemSpider ID29737695

More details:

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

1260876-31-0 [RN]
1H-Imidazole-2-carboxaldehyde, 5-bromo- [ACD/Index Name]
4-Brom-1H-imidazol-2-carbaldehyd [German] [ACD/IUPAC Name]
4-Bromo-1H-imidazole-2-carbaldehyde [ACD/IUPAC Name]
4-Bromo-1H-imidazole-2-carbaldéhyde [French] [ACD/IUPAC Name]
1H-IMIDAZOLE-4-BROMO-2-CARBOXALDEHYDE
4-BROMO-3H-IMIDAZOLE-2-CARBALDEHYDE
MFCD09842487

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

    Density: 2.0±0.1 g/cm3
    Boiling Point: 360.1±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.6±3.0 kJ/mol
    Flash Point: 171.6±25.7 °C
    Index of Refraction: 1.671
    Molar Refractivity: 33.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.44
    ACD/LogD (pH 5.5): 0.56
    ACD/BCF (pH 5.5): 1.56
    ACD/KOC (pH 5.5): 47.84
    ACD/LogD (pH 7.4): 0.54
    ACD/BCF (pH 7.4): 1.50
    ACD/KOC (pH 7.4): 45.88
    Polar Surface Area: 46 Å2
    Polarizability: 13.2±0.5 10-24cm3
    Surface Tension: 69.6±3.0 dyne/cm
    Molar Volume: 88.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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