ChemSpider 2D Image | 3-Iodo-4-(2-methyl-2-propanyl)benzoic acid | C11H13IO2

3-Iodo-4-(2-methyl-2-propanyl)benzoic acid

  • Molecular FormulaC11H13IO2
  • Average mass304.124 Da
  • Monoisotopic mass303.996002 Da
  • ChemSpider ID23960075

More details:

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

3-Iod-4-(2-methyl-2-propanyl)benzoesäure [German] [ACD/IUPAC Name]
3-Iodo-4-(2-methyl-2-propanyl)benzoic acid [ACD/IUPAC Name]
Acide 3-iodo-4-(2-méthyl-2-propanyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(1,1-dimethylethyl)-3-iodo- [ACD/Index Name]
[91131-72-5] [RN]
4-(tert-butyl)-3-iodobenzoic acid
4-(tert-butyl)-3-iodobenzoic acid???ws201115???
4-(tert-Butyl)-3-iodobenzoicacid
4-tert-butyl-3-iodobenzoic acid
4-tert-butyl-3-iodobenzoicacid
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 355.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.3±3.0 kJ/mol
    Flash Point: 168.6±27.9 °C
    Index of Refraction: 1.591
    Molar Refractivity: 64.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.80
    ACD/LogD (pH 5.5): 3.08
    ACD/BCF (pH 5.5): 58.09
    ACD/KOC (pH 5.5): 246.00
    ACD/LogD (pH 7.4): 1.60
    ACD/BCF (pH 7.4): 1.91
    ACD/KOC (pH 7.4): 8.10
    Polar Surface Area: 37 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 44.7±3.0 dyne/cm
    Molar Volume: 190.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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