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

Methyl 3-fluoro-2-iodobenzoate

  • Molecular FormulaC8H6FIO2
  • Average mass280.035 Da
  • Monoisotopic mass279.939636 Da
  • ChemSpider ID38238403

More details:

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

393-78-2 [RN]
3-Fluoro-2-iodobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-fluoro-2-iodo-, methyl ester [ACD/Index Name]
Methyl 3-fluoro-2-iodobenzoate [ACD/IUPAC Name]
Methyl-3-fluor-2-iodbenzoat [German] [ACD/IUPAC Name]
95%
METHYL 2-IODO-3-FLUOROBENZOATE
MFCD18399305

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 269.3±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.7±3.0 kJ/mol
    Flash Point: 116.7±23.2 °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: 2.90
    ACD/LogD (pH 5.5): 2.99
    ACD/BCF (pH 5.5): 110.13
    ACD/KOC (pH 5.5): 1007.43
    ACD/LogD (pH 7.4): 2.99
    ACD/BCF (pH 7.4): 110.13
    ACD/KOC (pH 7.4): 1007.43
    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


    Advertisement