ChemSpider 2D Image | 6-(Trifluoromethoxy)-11-oxatricyclo[6.2.1.0~2,7~]undeca-2,4,6,9-tetraene-9-carboxylic acid | C12H7F3O4

6-(Trifluoromethoxy)-11-oxatricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene-9-carboxylic acid

  • Molecular FormulaC12H7F3O4
  • Average mass272.177 Da
  • Monoisotopic mass272.029633 Da
  • ChemSpider ID34965635

More details:

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

1,4-Epoxynaphthalene-2-carboxylic acid, 1,4-dihydro-8-(trifluoromethoxy)- [ACD/Index Name]
6-(Trifluormethoxy)-11-oxatricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraen-9-carbonsäure [German] [ACD/IUPAC Name]
6-(Trifluoromethoxy)-11-oxatricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene-9-carboxylic acid [ACD/IUPAC Name]
Acide 6-(trifluorométhoxy)-11-oxatricyclo[6.2.1.02,7]undéca-2,4,6,9-tétraène-9-carboxylique [French] [ACD/IUPAC Name]
403646-75-3 [RN]
8-(trifluoromethoxy)-1,4-dihydro-1,4-epoxynaphthalene-2-carboxylic acid
AGN-PC-0NEY5Q
AKOS024262826
c12h7o4f3
MFCD30178101

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 354.5±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.3±3.0 kJ/mol
    Flash Point: 168.2±27.9 °C
    Index of Refraction: 1.567
    Molar Refractivity: 55.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.11
    ACD/LogD (pH 5.5): 0.71
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 10.02
    ACD/LogD (pH 7.4): -0.97
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 56 Å2
    Polarizability: 22.0±0.5 10-24cm3
    Surface Tension: 48.2±3.0 dyne/cm
    Molar Volume: 170.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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