ChemSpider 2D Image | Methyl 3-(benzyloxy)-4-iodobenzoate | C15H13IO3

Methyl 3-(benzyloxy)-4-iodobenzoate

  • Molecular FormulaC15H13IO3
  • Average mass368.166 Da
  • Monoisotopic mass367.990936 Da
  • ChemSpider ID59719680

More details:

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

3-(Benzyloxy)-4-iodobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-iodo-3-(phenylmethoxy)-, methyl ester [ACD/Index Name]
Methyl 3-(benzyloxy)-4-iodobenzoate [ACD/IUPAC Name]
Methyl-3-(benzyloxy)-4-iodbenzoat [German] [ACD/IUPAC Name]
877064-77-2 [RN]
95%
MFCD28347040

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 434.2±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.0±3.0 kJ/mol
    Flash Point: 216.4±27.3 °C
    Index of Refraction: 1.619
    Molar Refractivity: 82.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 5.05
    ACD/LogD (pH 5.5): 4.85
    ACD/BCF (pH 5.5): 2877.79
    ACD/KOC (pH 5.5): 10413.33
    ACD/LogD (pH 7.4): 4.85
    ACD/BCF (pH 7.4): 2877.79
    ACD/KOC (pH 7.4): 10413.33
    Polar Surface Area: 36 Å2
    Polarizability: 32.5±0.5 10-24cm3
    Surface Tension: 48.1±3.0 dyne/cm
    Molar Volume: 234.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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