ChemSpider 2D Image | 2-(3,4-Dimethoxyphenyl)-6,8-dimethyl-4-oxo-4H-chromen-3-yl 3,4,5-trimethoxybenzoate | C29H28O9

2-(3,4-Dimethoxyphenyl)-6,8-dimethyl-4-oxo-4H-chromen-3-yl 3,4,5-trimethoxybenzoate

  • Molecular FormulaC29H28O9
  • Average mass520.527 Da
  • Monoisotopic mass520.173340 Da
  • ChemSpider ID1313922

More details:

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

2-(3,4-Dimethoxyphenyl)-6,8-dimethyl-4-oxo-4H-chromen-3-yl 3,4,5-trimethoxybenzoate [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenyl)-6,8-dimethyl-4-oxo-4H-chromen-3-yl-3,4,5-trimethoxybenzoat [German] [ACD/IUPAC Name]
3,4,5-Triméthoxybenzoate de 2-(3,4-diméthoxyphényl)-6,8-diméthyl-4-oxo-4H-chromén-3-yle [French] [ACD/IUPAC Name]
Benzoic acid, 3,4,5-trimethoxy-, 2-(3,4-dimethoxyphenyl)-6,8-dimethyl-4-oxo-4H-1-benzopyran-3-yl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 620.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.9±3.0 kJ/mol
Flash Point: 262.3±31.5 °C
Index of Refraction: 1.610
Molar Refractivity: 136.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1061.61
ACD/KOC (pH 5.5): 5100.20
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1061.61
ACD/KOC (pH 7.4): 5100.20
Polar Surface Area: 99 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 56.2±5.0 dyne/cm
Molar Volume: 394.8±5.0 cm3

Click to predict properties on the Chemicalize site


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