ChemSpider 2D Image | Ethyl {[6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]oxy}acetate | C17H12BrF3N2O3

Ethyl {[6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]oxy}acetate

  • Molecular FormulaC17H12BrF3N2O3
  • Average mass429.188 Da
  • Monoisotopic mass427.998322 Da
  • ChemSpider ID21495960

More details:

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

{[6-(4-Bromophényl)-3-cyano-4-(trifluorométhyl)-2-pyridinyl]oxy}acétate d'éthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]oxy]-, ethyl ester [ACD/Index Name]
Ethyl {[6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]oxy}acetate [ACD/IUPAC Name]
Ethyl-{[6-(4-bromphenyl)-3-cyan-4-(trifluormethyl)-2-pyridinyl]oxy}acetat [German] [ACD/IUPAC Name]
924990-10-3 [RN]
AGN-PC-09R5XD
AQ-358/43417452
ethyl 2-((6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl)oxy)acetate
ethyl 2-[6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]oxyacetate
MCULE-8807927202
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 491.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.8±3.0 kJ/mol
    Flash Point: 251.0±28.7 °C
    Index of Refraction: 1.567
    Molar Refractivity: 88.7±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 5.61
    ACD/LogD (pH 5.5): 4.42
    ACD/BCF (pH 5.5): 1339.69
    ACD/KOC (pH 5.5): 6024.31
    ACD/LogD (pH 7.4): 4.42
    ACD/BCF (pH 7.4): 1339.69
    ACD/KOC (pH 7.4): 6024.31
    Polar Surface Area: 72 Å2
    Polarizability: 35.1±0.5 10-24cm3
    Surface Tension: 54.8±5.0 dyne/cm
    Molar Volume: 271.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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