ChemSpider 2D Image | Methyl 3-fluoro-5-iodobenzoate | C8H6FIO2

Methyl 3-fluoro-5-iodobenzoate

  • Molecular FormulaC8H6FIO2
  • Average mass280.035 Da
  • Monoisotopic mass279.939636 Da
  • ChemSpider ID48222575

More details:

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

3-Fluoro-5-iodobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-fluoro-5-iodo-, methyl ester [ACD/Index Name]
Methyl 3-fluoro-5-iodobenzoate [ACD/IUPAC Name]
Methyl-3-fluor-5-iodbenzoat [German] [ACD/IUPAC Name]
1261478-09-4 [RN]
MFCD18399306

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 289.3±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.9±3.0 kJ/mol
    Flash Point: 128.8±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: 3.56
    ACD/LogD (pH 5.5): 3.45
    ACD/BCF (pH 5.5): 246.02
    ACD/KOC (pH 5.5): 1790.84
    ACD/LogD (pH 7.4): 3.45
    ACD/BCF (pH 7.4): 246.02
    ACD/KOC (pH 7.4): 1790.84
    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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