ChemSpider 2D Image | 4-[(4-Hydroxy-3,5-dimethoxybenzoyl)oxy]-3,5-dimethoxybenzoic acid | C18H18O9

4-[(4-Hydroxy-3,5-dimethoxybenzoyl)oxy]-3,5-dimethoxybenzoic acid

  • Molecular FormulaC18H18O9
  • Average mass378.330 Da
  • Monoisotopic mass378.095093 Da
  • ChemSpider ID58823470

More details:

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

4-[(4-Hydroxy-3,5-dimethoxybenzoyl)oxy]-3,5-dimethoxybenzoesäure [German] [ACD/IUPAC Name]
4-[(4-Hydroxy-3,5-dimethoxybenzoyl)oxy]-3,5-dimethoxybenzoic acid [ACD/IUPAC Name]
Acide 4-[(4-hydroxy-3,5-diméthoxybenzoyl)oxy]-3,5-diméthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-hydroxy-3,5-dimethoxy-, 4-carboxy-2,6-dimethoxyphenyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 650.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.8±3.0 kJ/mol
Flash Point: 235.5±25.0 °C
Index of Refraction: 1.582
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 1.47
ACD/KOC (pH 5.5): 13.89
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 279.8±3.0 cm3

Click to predict properties on the Chemicalize site


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