ChemSpider 2D Image | 4-(1,8-Dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl 4-(2-methyl-2-propanyl)benzoate | C32H34O6

4-(1,8-Dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl 4-(2-methyl-2-propanyl)benzoate

  • Molecular FormulaC32H34O6
  • Average mass514.609 Da
  • Monoisotopic mass514.235535 Da
  • ChemSpider ID3027732

More details:

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

4-(1,8-Dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl 4-(2-methyl-2-propanyl)benzoate [ACD/IUPAC Name]
4-(1,8-Dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl-4-(2-methyl-2-propanyl)benzoat [German] [ACD/IUPAC Name]
4-(2-Méthyl-2-propanyl)benzoate de 4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthén-9-yl)-2-éthoxyphényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(1,1-dimethylethyl)-, 2-ethoxy-4-(2,3,4,5,6,7,8,9-octahydro-1,8-dioxo-1H-xanthen-9-yl)phenyl ester [ACD/Index Name]
[4-(1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-xanthen-9-yl)-2-ethoxyphenyl] 4-tert-butylbenzoate
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl 4-(tert-butyl)benzoate
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl 4-tert-butylbenzoate
4-tert-Butyl-benzoic acid 4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxy-phenyl ester
836626-38-1 [RN]
AC1MWJTI
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 708.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 103.6±3.0 kJ/mol
    Flash Point: 297.6±32.9 °C
    Index of Refraction: 1.606
    Molar Refractivity: 142.4±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 5.61
    ACD/LogD (pH 5.5): 5.93
    ACD/BCF (pH 5.5): 18863.88
    ACD/KOC (pH 5.5): 40002.14
    ACD/LogD (pH 7.4): 5.93
    ACD/BCF (pH 7.4): 18863.88
    ACD/KOC (pH 7.4): 40002.14
    Polar Surface Area: 79 Å2
    Polarizability: 56.5±0.5 10-24cm3
    Surface Tension: 53.4±5.0 dyne/cm
    Molar Volume: 412.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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