ChemSpider 2D Image | 2-(3-Hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4-oxo-4H-chromen-5-olate | C18H15O7

2-(3-Hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4-oxo-4H-chromen-5-olate

  • Molecular FormulaC18H15O7
  • Average mass343.308 Da
  • Monoisotopic mass343.082336 Da
  • ChemSpider ID31150387

  • Charge - Charge

More details:

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

2-(3-Hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4-oxo-4H-chromen-5-olat [German] [ACD/IUPAC Name]
2-(3-Hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4-oxo-4H-chromen-5-olate [ACD/IUPAC Name]
2-(3-Hydroxy-4-méthoxyphényl)-3,7-diméthoxy-4-oxo-4H-chromén-5-olate [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-, ion(1-) [ACD/Index Name]
2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4-oxo-4H-1-benzopyran-5-olate
3',5-Dihydroxy-3,4',7-trimethoxyflavone
3',5-dihydroxy-3,4',7-trimethoxyflavone(1-)
3,7,4'-O-trimethylquercetin
3,7,4'-tri-O-methylquercetin-5-olate
  • Miscellaneous

    • Chemical Class:

      A flavonoid oxoanion obtained by deprotonation of the 5-hydroxy group of 3',5-dihydroxy-3,4',7-trimethoxyflavone. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:77770

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

Density:
Boiling Point: 600.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 221.5±25.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 44.22
ACD/KOC (pH 5.5): 494.72
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 2.89
ACD/KOC (pH 7.4): 32.29
Polar Surface Area: 97 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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