ChemSpider 2D Image | 11-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}phenoxy)undecanoic acid | C22H34O5

11-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}phenoxy)undecanoic acid

  • Molecular FormulaC22H34O5
  • Average mass378.502 Da
  • Monoisotopic mass378.240631 Da
  • ChemSpider ID64854993

More details:

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

11-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}phenoxy)undecanoic acid [ACD/IUPAC Name]
11-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}phenoxy)undecansäure [German] [ACD/IUPAC Name]
Acide 11-(4-{[(2-méthyl-2-propanyl)oxy]carbonyl}phénoxy)undécanoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(10-carboxydecyl)oxy]-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
11-(4-(tert-butoxycarbonyl)phenoxy)undecanoic acid
11-{4-[(tert-butoxy)carbonyl]phenoxy}undecanoic acid
905303-17-5 [RN]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.0±0.1 g/cm3
    Boiling Point: 514.4±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.8±3.0 kJ/mol
    Flash Point: 169.2±15.3 °C
    Index of Refraction: 1.502
    Molar Refractivity: 106.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 15
    #Rule of 5 Violations: 1
    ACD/LogP: 6.71
    ACD/LogD (pH 5.5): 5.04
    ACD/BCF (pH 5.5): 2561.81
    ACD/KOC (pH 5.5): 5689.29
    ACD/LogD (pH 7.4): 3.24
    ACD/BCF (pH 7.4): 41.09
    ACD/KOC (pH 7.4): 91.26
    Polar Surface Area: 73 Å2
    Polarizability: 42.2±0.5 10-24cm3
    Surface Tension: 39.3±3.0 dyne/cm
    Molar Volume: 360.6±3.0 cm3

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