ChemSpider 2D Image | 5-IODO-1-ISOBUTYLPYRAZOLE | C7H11IN2

5-IODO-1-ISOBUTYLPYRAZOLE

  • Molecular FormulaC7H11IN2
  • Average mass250.080 Da
  • Monoisotopic mass249.996689 Da
  • ChemSpider ID28535538

More details:

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

1345471-53-5 [RN]
1H-Pyrazole, 5-iodo-1-(2-methylpropyl)- [ACD/Index Name]
5-Iod-1-isobutyl-1H-pyrazol [German] [ACD/IUPAC Name]
5-Iodo-1-(2-methylpropyl)-1H-pyrazole
5-iodo-1-(2-methylpropyl)pyrazole
5-Iodo-1-isobutyl-1H-pyrazole [ACD/IUPAC Name]
5-Iodo-1-isobutyl-1H-pyrazole [French] [ACD/IUPAC Name]
5-IODO-1-ISOBUTYLPYRAZOLE
[1345471-53-5] [RN]
3-Iodo-2-isobutylpyrazole
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.7±0.1 g/cm3
    Boiling Point: 264.1±13.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.2±3.0 kJ/mol
    Flash Point: 113.5±19.8 °C
    Index of Refraction: 1.614
    Molar Refractivity: 51.5±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): 2.75
    ACD/BCF (pH 5.5): 72.25
    ACD/KOC (pH 5.5): 745.05
    ACD/LogD (pH 7.4): 2.75
    ACD/BCF (pH 7.4): 72.26
    ACD/KOC (pH 7.4): 745.07
    Polar Surface Area: 18 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 39.8±7.0 dyne/cm
    Molar Volume: 147.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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