ChemSpider 2D Image | Methyl 3-fluoro-2-(trifluoromethyl)isonicotinate | C8H5F4NO2

Methyl 3-fluoro-2-(trifluoromethyl)isonicotinate

  • Molecular FormulaC8H5F4NO2
  • Average mass223.124 Da
  • Monoisotopic mass223.025635 Da
  • ChemSpider ID24589049

More details:

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

1227594-82-2 [RN]
3-Fluoro-2-(trifluorométhyl)isonicotinate de méthyle [French] [ACD/IUPAC Name]
4-Pyridinecarboxylic acid, 3-fluoro-2-(trifluoromethyl)-, methyl ester [ACD/Index Name]
Methyl 3-fluoro-2-(trifluoromethyl)isonicotinate [ACD/IUPAC Name]
Methyl-3-fluor-2-(trifluormethyl)isonicotinat [German] [ACD/IUPAC Name]
CS-16289
methyl 3-fluoro-2-(trifluoromethyl)pyridine-4-carboxylate
methyl3-fluoro-2-(trifluoromethyl)isonicotinate
MFCD16611619

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 221.5±40.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 45.8±3.0 kJ/mol
    Flash Point: 87.7±27.3 °C
    Index of Refraction: 1.432
    Molar Refractivity: 41.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.11
    ACD/LogD (pH 5.5): 2.37
    ACD/BCF (pH 5.5): 37.22
    ACD/KOC (pH 5.5): 463.41
    ACD/LogD (pH 7.4): 2.37
    ACD/BCF (pH 7.4): 37.22
    ACD/KOC (pH 7.4): 463.41
    Polar Surface Area: 39 Å2
    Polarizability: 16.3±0.5 10-24cm3
    Surface Tension: 30.1±3.0 dyne/cm
    Molar Volume: 158.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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