ChemSpider 2D Image | 3-(Difluoromethyl)-2-pyrazinecarboxylic acid | C6H4F2N2O2

3-(Difluoromethyl)-2-pyrazinecarboxylic acid

  • Molecular FormulaC6H4F2N2O2
  • Average mass174.105 Da
  • Monoisotopic mass174.024078 Da
  • ChemSpider ID35490871

More details:

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

1443287-46-4 [RN]
2-Pyrazinecarboxylic acid, 3-(difluoromethyl)- [ACD/Index Name]
3-(Difluormethyl)-2-pyrazincarbonsäure [German] [ACD/IUPAC Name]
3-(Difluoromethyl)-2-pyrazinecarboxylic acid [ACD/IUPAC Name]
3-(difluoromethyl)pyrazine-2-carboxylic acid
Acide 3-(difluorométhyl)-2-pyrazinecarboxylique [French] [ACD/IUPAC Name]
3-Difluoromethyl-pyrazine-2-carboxylic acid
AGN-PC-0H97VG
difluoromethylpyrazinecarboxylic acid
MFCD25368595
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 316.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.9±3.0 kJ/mol
    Flash Point: 145.4±27.9 °C
    Index of Refraction: 1.507
    Molar Refractivity: 34.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.99
    ACD/LogD (pH 5.5): -2.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.80
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 63 Å2
    Polarizability: 13.7±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 116.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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