ChemSpider 2D Image | 4,5-Dibromo-1-methyl-1H-pyrazole | C4H4Br2N2

4,5-Dibromo-1-methyl-1H-pyrazole

  • Molecular FormulaC4H4Br2N2
  • Average mass239.896 Da
  • Monoisotopic mass237.874115 Da
  • ChemSpider ID37550304

More details:

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

1H-Pyrazole, 4,5-dibromo-1-methyl- [ACD/Index Name]
4,5-Dibrom-1-methyl-1H-pyrazol [German] [ACD/IUPAC Name]
4,5-Dibromo-1-methyl-1H-pyrazole [ACD/IUPAC Name]
4,5-Dibromo-1-méthyl-1H-pyrazole [French] [ACD/IUPAC Name]
4,5-dibromo-1-methyl-pyrazole
70951-86-9 [RN]
MFCD26679039

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

    Density: 2.2±0.1 g/cm3
    Boiling Point: 267.9±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.6±3.0 kJ/mol
    Flash Point: 115.8±21.8 °C
    Index of Refraction: 1.672
    Molar Refractivity: 40.4±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.23
    ACD/LogD (pH 5.5): 2.34
    ACD/BCF (pH 5.5): 35.02
    ACD/KOC (pH 5.5): 443.67
    ACD/LogD (pH 7.4): 2.34
    ACD/BCF (pH 7.4): 35.02
    ACD/KOC (pH 7.4): 443.67
    Polar Surface Area: 18 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 50.5±7.0 dyne/cm
    Molar Volume: 107.8±7.0 cm3

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