ChemSpider 2D Image | Methyl 4-[4-(trifluoromethyl)-2-pyridinyl]benzoate | C14H10F3NO2

Methyl 4-[4-(trifluoromethyl)-2-pyridinyl]benzoate

  • Molecular FormulaC14H10F3NO2
  • Average mass281.230 Da
  • Monoisotopic mass281.066376 Da
  • ChemSpider ID26052852

More details:

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

1299607-44-5 [RN]
4-[4-(Trifluorométhyl)-2-pyridinyl]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[4-(trifluoromethyl)-2-pyridinyl]-, methyl ester [ACD/Index Name]
Methyl 4-[4-(trifluoromethyl)-2-pyridinyl]benzoate [ACD/IUPAC Name]
Methyl 4-[4-(trifluoromethyl)pyridin-2-yl]benzoate
Methyl-4-[4-(trifluormethyl)-2-pyridinyl]benzoat [German] [ACD/IUPAC Name]
4-(4-Trifluoromethylpyridin-2-yl)benzoic acid methyl ester
4-(4-Trifluoromethylpyridin-2-yl)-benzoic acid methyl ester
4-(4-Trifluoromethyl-pyridin-2-yl)-benzoic acid methyl ester
4-(4-Trifluoromethyl-pyridin-2-yl)-benzoic acidmethyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 367.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.3±3.0 kJ/mol
    Flash Point: 175.8±27.9 °C
    Index of Refraction: 1.511
    Molar Refractivity: 65.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.47
    ACD/LogD (pH 5.5): 3.19
    ACD/BCF (pH 5.5): 157.19
    ACD/KOC (pH 5.5): 1299.55
    ACD/LogD (pH 7.4): 3.19
    ACD/BCF (pH 7.4): 157.21
    ACD/KOC (pH 7.4): 1299.69
    Polar Surface Area: 39 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 35.9±3.0 dyne/cm
    Molar Volume: 219.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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