ChemSpider 2D Image | Flavogallonic acid | C21H10O13

Flavogallonic acid

  • Molecular FormulaC21H10O13
  • Average mass470.296 Da
  • Monoisotopic mass470.012146 Da
  • ChemSpider ID22370073

More details:

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

103744-88-3 [RN]
3,4,5-Trihydroxy-2-(2,3,7,8-tetrahydroxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-1-yl)benzoesäure [German] [ACD/IUPAC Name]
3,4,5-Trihydroxy-2-(2,3,7,8-tetrahydroxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-1-yl)benzoic acid [ACD/IUPAC Name]
Acide 3,4,5-trihydroxy-2-(2,3,7,8-tétrahydroxy-5,10-dioxo-5,10-dihydrochroméno[5,4,3-cde]chromén-1-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-(5,10-dihydro-2,3,7,8-tetrahydroxy-5,10-dioxo[1]benzopyrano[5,4,3-cde][1]benzopyran-1-yl)-3,4,5-trihydroxy- [ACD/Index Name]
Flavogallonic acid [Wiki]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 992.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.7±3.0 kJ/mol
Flash Point: 352.5±27.8 °C
Index of Refraction: 1.937
Molar Refractivity: 104.9±0.3 cm3
#H bond acceptors: 13
#H bond donors: 8
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: -0.35
ACD/LogD (pH 5.5): -3.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 232 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 161.2±3.0 dyne/cm
Molar Volume: 219.3±3.0 cm3

Click to predict properties on the Chemicalize site


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