ChemSpider 2D Image | Dibenzyl 4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate | C30H30O7

Dibenzyl 4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate

  • Molecular FormulaC30H30O7
  • Average mass502.555 Da
  • Monoisotopic mass502.199158 Da
  • ChemSpider ID2250921

More details:

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

1,3-Cyclohexanedicarboxylic acid, 4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxo-, bis(phenylmethyl) ester [ACD/Index Name]
4-Hydroxy-2-(4-méthoxyphényl)-4-méthyl-6-oxo-1,3-cyclohexanedicarboxylate de dibenzyle [French] [ACD/IUPAC Name]
Dibenzyl 4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate [ACD/IUPAC Name]
Dibenzyl-4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxo-1,3-cyclohexandicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 658.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 214.1±25.0 °C
Index of Refraction: 1.590
Molar Refractivity: 136.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2489.96
ACD/KOC (pH 5.5): 9388.06
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2467.72
ACD/KOC (pH 7.4): 9304.21
Polar Surface Area: 99 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 403.2±3.0 cm3

Click to predict properties on the Chemicalize site


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