ChemSpider 2D Image | 5-Hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-one | C17H14O6

5-Hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-one

  • Molecular FormulaC17H14O6
  • Average mass314.289 Da
  • Monoisotopic mass314.079041 Da
  • ChemSpider ID24842847

More details:

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

104668-88-4 [RN]
4H-1-Benzopyran-4-one, 5-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methoxy- [ACD/Index Name]
5-Hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
5-Hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-one [ACD/IUPAC Name]
5-Hydroxy-3-(4-hydroxy-3-méthoxyphényl)-7-méthoxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
"7,3`-DIMETHYLOROBOL"
3',7-Di-O-methylorobol
4',5-Dihydroxy-3',7-dimethoxyisoflavone
5,4'-Dihydroxy-7,3'-dimethoxyisoflavone
5-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methoxychromen-4-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.4±0.1 g/cm3
Boiling Point: 567.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 213.1±23.6 °C
Index of Refraction: 1.646
Molar Refractivity: 81.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 81.69
ACD/KOC (pH 5.5): 772.93
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 5.90
ACD/KOC (pH 7.4): 55.85
Polar Surface Area: 85 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 59.9±3.0 dyne/cm
Molar Volume: 224.1±3.0 cm3

Click to predict properties on the Chemicalize site


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