ChemSpider 2D Image | 2-Fluoro-6-(trifluoromethoxy)benzoic acid | C8H4F4O3

2-Fluoro-6-(trifluoromethoxy)benzoic acid

  • Molecular FormulaC8H4F4O3
  • Average mass224.109 Da
  • Monoisotopic mass224.009659 Da
  • ChemSpider ID59759269

More details:

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

1211530-22-1 [RN]
2-Fluor-6-(trifluormethoxy)benzoesäure [German] [ACD/IUPAC Name]
2-Fluoro-6-(trifluoromethoxy)benzoic acid [ACD/IUPAC Name]
Acide 2-fluoro-6-(trifluorométhoxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-fluoro-6-(trifluoromethoxy)- [ACD/Index Name]
MFCD22551466

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 215.0±35.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 47.7±3.0 kJ/mol
    Flash Point: 83.8±25.9 °C
    Index of Refraction: 1.462
    Molar Refractivity: 40.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.54
    ACD/LogD (pH 5.5): -0.30
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.45
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 47 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 35.1±3.0 dyne/cm
    Molar Volume: 146.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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