ChemSpider 2D Image | 3,4-Diiodo-5-methyl-1H-pyrazole | C4H4I2N2

3,4-Diiodo-5-methyl-1H-pyrazole

  • Molecular FormulaC4H4I2N2
  • Average mass333.897 Da
  • Monoisotopic mass333.846375 Da
  • ChemSpider ID34977422

More details:

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

1H-Pyrazole, 3,4-diiodo-5-methyl- [ACD/Index Name]
3,4-Diiod-5-methyl-1H-pyrazol [German] [ACD/IUPAC Name]
3,4-Diiodo-5-methyl-1H-pyrazole [ACD/IUPAC Name]
3,4-Diiodo-5-méthyl-1H-pyrazole [French] [ACD/IUPAC Name]
6715-87-3 [RN]
3,4-Diiodo-5-methylpyrazole
4,5-Diiodo-3-methyl-1H-pyrazole
DS-9052
MFCD20484310

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

    Density: 2.8±0.1 g/cm3
    Boiling Point: 374.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.8±3.0 kJ/mol
    Flash Point: 180.5±27.9 °C
    Index of Refraction: 1.749
    Molar Refractivity: 49.4±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 3.40
    ACD/LogD (pH 5.5): 2.82
    ACD/BCF (pH 5.5): 82.26
    ACD/KOC (pH 5.5): 817.51
    ACD/LogD (pH 7.4): 2.82
    ACD/BCF (pH 7.4): 82.22
    ACD/KOC (pH 7.4): 817.16
    Polar Surface Area: 29 Å2
    Polarizability: 19.6±0.5 10-24cm3
    Surface Tension: 69.0±3.0 dyne/cm
    Molar Volume: 121.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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