ChemSpider 2D Image | Methyl 2-fluoro-3-iodobenzoate | C8H6FIO2

Methyl 2-fluoro-3-iodobenzoate

  • Molecular FormulaC8H6FIO2
  • Average mass280.035 Da
  • Monoisotopic mass279.939636 Da
  • ChemSpider ID30803115

More details:

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

1260830-14-5 [RN]
2-Fluoro-3-iodobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-fluoro-3-iodo-, methyl ester [ACD/Index Name]
Methyl 2-fluoro-3-iodobenzoate [ACD/IUPAC Name]
Methyl-2-fluor-3-iodbenzoat [German] [ACD/IUPAC Name]
95%
MFCD12032199

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 298.3±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.8±3.0 kJ/mol
    Flash Point: 134.2±24.6 °C
    Index of Refraction: 1.577
    Molar Refractivity: 50.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.97
    ACD/LogD (pH 5.5): 3.01
    ACD/BCF (pH 5.5): 114.19
    ACD/KOC (pH 5.5): 1033.83
    ACD/LogD (pH 7.4): 3.01
    ACD/BCF (pH 7.4): 114.19
    ACD/KOC (pH 7.4): 1033.83
    Polar Surface Area: 26 Å2
    Polarizability: 20.2±0.5 10-24cm3
    Surface Tension: 43.7±3.0 dyne/cm
    Molar Volume: 153.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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