ChemSpider 2D Image | 3-Iodo-4-methylbenzaldehyde | C8H7IO

3-Iodo-4-methylbenzaldehyde

  • Molecular FormulaC8H7IO
  • Average mass246.045 Da
  • Monoisotopic mass245.954147 Da
  • ChemSpider ID11281968

More details:

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

3-Iod-4-methylbenzaldehyd [German] [ACD/IUPAC Name]
3-Iodo-4-methylbenzaldehyde [ACD/IUPAC Name]
3-Iodo-4-methyl-benzaldehyde
3-Iodo-4-méthylbenzaldéhyde [French] [ACD/IUPAC Name]
58586-55-3 [RN]
Benzaldehyde, 3-iodo-4-methyl- [ACD/Index Name]
[58586-55-3] [RN]
3-IODO-4-METHYLBENZALDEHYDE|3-IODO-4-METHYLBENZALDEHYDE
MFCD08703356 [MDL number]

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 284.0±28.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.3±3.0 kJ/mol
    Flash Point: 125.5±24.0 °C
    Index of Refraction: 1.648
    Molar Refractivity: 50.7±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.33
    ACD/LogD (pH 5.5): 2.95
    ACD/BCF (pH 5.5): 102.03
    ACD/KOC (pH 5.5): 953.77
    ACD/LogD (pH 7.4): 2.95
    ACD/BCF (pH 7.4): 102.03
    ACD/KOC (pH 7.4): 953.77
    Polar Surface Area: 17 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 47.2±3.0 dyne/cm
    Molar Volume: 139.4±3.0 cm3

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