ChemSpider 2D Image | Ethyl (3,5-dimethylphenyl)(difluoro)acetate | C12H14F2O2

Ethyl (3,5-dimethylphenyl)(difluoro)acetate

  • Molecular FormulaC12H14F2O2
  • Average mass228.235 Da
  • Monoisotopic mass228.096191 Da
  • ChemSpider ID26551561

More details:

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

(3,5-Diméthylphényl)(difluoro)acétate d'éthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, α,α-difluoro-3,5-dimethyl-, ethyl ester [ACD/Index Name]
Ethyl (3,5-dimethylphenyl)(difluoro)acetate [ACD/IUPAC Name]
Ethyl-(3,5-dimethylphenyl)(difluor)acetat [German] [ACD/IUPAC Name]
1248927-78-7 [RN]
Ethyl 2-(3,5-dimethylphenyl)-2,2-difluoroacetate
MFCD16036834

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 266.8±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.5±3.0 kJ/mol
    Flash Point: 111.7±20.8 °C
    Index of Refraction: 1.468
    Molar Refractivity: 56.4±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.02
    ACD/LogD (pH 5.5): 3.78
    ACD/BCF (pH 5.5): 442.60
    ACD/KOC (pH 5.5): 2726.57
    ACD/LogD (pH 7.4): 3.78
    ACD/BCF (pH 7.4): 442.60
    ACD/KOC (pH 7.4): 2726.57
    Polar Surface Area: 26 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 29.8±3.0 dyne/cm
    Molar Volume: 203.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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