ChemSpider 2D Image | 1-(2-Fluoroethyl)-5-methyl-1H-pyrazole-3-carboxylic acid | C7H9FN2O2

1-(2-Fluoroethyl)-5-methyl-1H-pyrazole-3-carboxylic acid

  • Molecular FormulaC7H9FN2O2
  • Average mass172.157 Da
  • Monoisotopic mass172.064804 Da
  • ChemSpider ID32838438

More details:

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

1-(2-Fluorethyl)-5-methyl-1H-pyrazol-3-carbonsäure [German] [ACD/IUPAC Name]
1-(2-Fluoroethyl)-5-methyl-1H-pyrazole-3-carboxylic acid [ACD/IUPAC Name]
1427014-31-0 [RN]
1H-Pyrazole-3-carboxylic acid, 1-(2-fluoroethyl)-5-methyl- [ACD/Index Name]
Acide 1-(2-fluoroéthyl)-5-méthyl-1H-pyrazole-3-carboxylique [French] [ACD/IUPAC Name]
1-(2-Fluoro-ethyl)-5-methyl-1H-pyrazole-3-carboxylic acid
1-(2-fluoroethyl)-5-methylpyrazole-3-carboxylic acid
KS-9054
MFCD23130708

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 333.5±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.8±3.0 kJ/mol
    Flash Point: 155.5±25.1 °C
    Index of Refraction: 1.544
    Molar Refractivity: 40.7±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.44
    ACD/LogD (pH 5.5): -0.33
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.91
    ACD/LogD (pH 7.4): -1.88
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 55 Å2
    Polarizability: 16.1±0.5 10-24cm3
    Surface Tension: 41.9±7.0 dyne/cm
    Molar Volume: 128.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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