ChemSpider 2D Image | Ethyl 2-fluoro-5-methylbenzoate | C10H11FO2

Ethyl 2-fluoro-5-methylbenzoate

  • Molecular FormulaC10H11FO2
  • Average mass182.191 Da
  • Monoisotopic mass182.074310 Da
  • ChemSpider ID23348651

More details:

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

2-Fluoro-5-méthylbenzoate d'éthyle [French] [ACD/IUPAC Name]
496841-90-8 [RN]
Benzoic acid, 2-fluoro-5-methyl-, ethyl ester [ACD/Index Name]
Ethyl 2-fluoro-5-methylbenzoate [ACD/IUPAC Name]
Ethyl-2-fluor-5-methylbenzoat [German] [ACD/IUPAC Name]
[496841-90-8] [RN]
Ethyl2-Fluoro-5-methylbenzoate
MFCD06204763 [MDL number]
QB-1411

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 247.9±28.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.5±3.0 kJ/mol
    Flash Point: 100.8±18.9 °C
    Index of Refraction: 1.490
    Molar Refractivity: 47.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.94
    ACD/LogD (pH 5.5): 2.92
    ACD/BCF (pH 5.5): 96.83
    ACD/KOC (pH 5.5): 918.74
    ACD/LogD (pH 7.4): 2.92
    ACD/BCF (pH 7.4): 96.83
    ACD/KOC (pH 7.4): 918.74
    Polar Surface Area: 26 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 34.0±3.0 dyne/cm
    Molar Volume: 164.3±3.0 cm3

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