ChemSpider 2D Image | 5,7,4'-Trihydroxy-3,6-dimethoxy-3'-prenylflavone | C22H22O7

5,7,4'-Trihydroxy-3,6-dimethoxy-3'-prenylflavone

  • Molecular FormulaC22H22O7
  • Average mass398.406 Da
  • Monoisotopic mass398.136566 Da
  • ChemSpider ID29365173

More details:






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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-3,6-dimethoxy- [ACD/Index Name]
5,7,4'-Trihydroxy-3,6-dimethoxy-3'-prenylflavone
5,7-Dihydroxy-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-3,6-dimethoxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-3,6-dimethoxy-4H-chromen-4-one [ACD/IUPAC Name]
5,7-Dihydroxy-2-[4-hydroxy-3-(3-méthyl-2-butén-1-yl)phényl]-3,6-diméthoxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
959421-20-6 [RN]
[959421-20-6] [RN]
5,7,4-Trihydroxy-3,6-dimethoxy-3-prenylflavone
MFCD25973149

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

Density: 1.4±0.1 g/cm3
Boiling Point: 651.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.5±3.0 kJ/mol
Flash Point: 229.3±25.0 °C
Index of Refraction: 1.655
Molar Refractivity: 104.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 296.67
ACD/KOC (pH 5.5): 1929.23
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 13.08
ACD/KOC (pH 7.4): 85.05
Polar Surface Area: 105 Å2
Polarizability: 41.5±0.5 10-24cm3
Surface Tension: 67.8±5.0 dyne/cm
Molar Volume: 285.4±5.0 cm3

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