ChemSpider 2D Image | 4-iodo-2-propylpyrazole-3-carboxylic acid | C7H9IN2O2

4-iodo-2-propylpyrazole-3-carboxylic acid

  • Molecular FormulaC7H9IN2O2
  • Average mass280.063 Da
  • Monoisotopic mass279.970856 Da
  • ChemSpider ID28603054

More details:

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

1354705-23-9 [RN]
1H-Pyrazole-5-carboxylic acid, 4-iodo-1-propyl- [ACD/Index Name]
4-Iod-1-propyl-1H-pyrazol-5-carbonsäure [German] [ACD/IUPAC Name]
4-Iodo-1-propyl-1H-pyrazole-5-carboxylic acid [ACD/IUPAC Name]
4-iodo-2-propylpyrazole-3-carboxylic acid
Acide 4-iodo-1-propyl-1H-pyrazole-5-carboxylique [French] [ACD/IUPAC Name]
1004643-68-8 [RN]
4-iodo-1-propylpyrazole-5-carboxylic acid
4-Iodo-2-propyl-2H-pyrazole-3-carboxylic acid
AGN-PC-0DA65K
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 2.0±0.1 g/cm3
    Boiling Point: 371.9±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.3±3.0 kJ/mol
    Flash Point: 178.7±23.7 °C
    Index of Refraction: 1.667
    Molar Refractivity: 53.4±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.33
    ACD/LogD (pH 5.5): -0.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.15
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 55 Å2
    Polarizability: 21.2±0.5 10-24cm3
    Surface Tension: 54.7±7.0 dyne/cm
    Molar Volume: 143.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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