ChemSpider 2D Image | 5-[3-(Trifluoromethoxy)phenoxy]-2-pyrazinecarboxylic acid | C12H7F3N2O4

5-[3-(Trifluoromethoxy)phenoxy]-2-pyrazinecarboxylic acid

  • Molecular FormulaC12H7F3N2O4
  • Average mass300.190 Da
  • Monoisotopic mass300.035797 Da
  • ChemSpider ID23079605

More details:

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

2-Pyrazinecarboxylic acid, 5-[3-(trifluoromethoxy)phenoxy]- [ACD/Index Name]
5-[3-(Trifluormethoxy)phenoxy]-2-pyrazincarbonsäure [German] [ACD/IUPAC Name]
5-[3-(Trifluoromethoxy)phenoxy]-2-pyrazinecarboxylic acid [ACD/IUPAC Name]
5-[3-(Trifluoromethoxy)phenoxy]pyrazine-2-carboxylic acid [ACD/IUPAC Name]
Acide 5-[3-(trifluorométhoxy)phénoxy]-2-pyrazinecarboxylique [French] [ACD/IUPAC Name]
T6N DNJ BVQ EOR COXFFF [WLN]
1199215-63-8 [RN]
MFCD13248691 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 390.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 67.5±3.0 kJ/mol
    Flash Point: 190.1±27.9 °C
    Index of Refraction: 1.544
    Molar Refractivity: 62.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.31
    ACD/LogD (pH 5.5): -0.41
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.10
    ACD/LogD (pH 7.4): -1.09
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 82 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 49.6±3.0 dyne/cm
    Molar Volume: 199.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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