ChemSpider 2D Image | 5,7-Dihydroxy-3,6-dimethoxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one | C17H14O9

5,7-Dihydroxy-3,6-dimethoxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one

  • Molecular FormulaC17H14O9
  • Average mass362.288 Da
  • Monoisotopic mass362.063782 Da
  • ChemSpider ID24845601

More details:

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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-3,6-dimethoxy-2-(3,4,5-trihydroxyphenyl)- [ACD/Index Name]
5,7-Dihydroxy-3,6-dimethoxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-3,6-dimethoxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one [ACD/IUPAC Name]
5,7-Dihydroxy-3,6-diméthoxy-2-(3,4,5-trihydroxyphényl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
5,7,3',4',5'-Pentahydroxy-3,6-dimethoxyflavone

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

Density: 1.8±0.1 g/cm3
Boiling Point: 748.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.9±3.0 kJ/mol
Flash Point: 277.8±26.4 °C
Index of Refraction: 1.765
Molar Refractivity: 85.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.42
ACD/KOC (pH 5.5): 174.72
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.00
Polar Surface Area: 146 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 110.8±5.0 dyne/cm
Molar Volume: 205.6±5.0 cm3

Click to predict properties on the Chemicalize site


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