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Search term: REFJWTPEDVJJIY-UHFFFAOYSA-M (Found by InChIKey (full match))
ChemSpider 2D Image | quercetin-3-olate | C15H9O7

quercetin-3-olate

  • Molecular FormulaC15H9O7
  • Average mass301.228 Da
  • Monoisotopic mass301.035370 Da
  • ChemSpider ID26330877

  • Charge - Charge

More details:

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

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-olat [German] [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-olate [ACD/IUPAC Name]
2-(3,4-Dihydroxyphényl)-5,7-dihydroxy-4-oxo-4H-chromén-3-olate [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-, ion(1-) [ACD/Index Name]
quercetin-3-olate
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4-oxo-4-chromen-7-olate
3,5,7,3',4'-pentahydroflavone
3,5,7,3',4'-Pentahydroxyflavone
Quercetin [Wiki]
quercetin anion
More...

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

CHEBI:57694 [DBID]
  • Miscellaneous

    • Chemical Class:

      Conjugate base of quercetin arising from selective deprotonation of the 7-hydroxy group; major species at pH 7.3. ChEBI CHEBI:57694

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

Density:
Boiling Point: 642.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.3±3.0 kJ/mol
Flash Point: 248.1±25.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 14.99
ACD/KOC (pH 5.5): 230.01
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.82
Polar Surface Area: 130 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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