ChemSpider 2D Image | 5-Hydroxy-2-methyl-4-oxo-4H-chromen-7-olate | C10H7O4

5-Hydroxy-2-methyl-4-oxo-4H-chromen-7-olate

  • Molecular FormulaC10H7O4
  • Average mass191.161 Da
  • Monoisotopic mass191.034988 Da
  • ChemSpider ID31150451

  • Charge - Charge

More details:

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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-methyl-, ion(1-) [ACD/Index Name]
5-Hydroxy-2-methyl-4-oxo-4H-chromen-7-olat [German] [ACD/IUPAC Name]
5-Hydroxy-2-methyl-4-oxo-4H-chromen-7-olate [ACD/IUPAC Name]
5-Hydroxy-2-méthyl-4-oxo-4H-chromén-7-olate [French] [ACD/IUPAC Name]
5,7-Dihydroxy-2-methyl-4H-chromen-4-one [ACD/IUPAC Name]
Noreugenin
noreugenin(1-)
  • Miscellaneous

    • Chemical Class:

      A phenolate anion obtained by deprotonation of the 7-hydroxy group of noreugenin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:77977

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

Density:
Boiling Point: 394.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.0±3.0 kJ/mol
Flash Point: 164.0±21.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.19
ACD/KOC (pH 5.5): 246.93
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.34
ACD/KOC (pH 7.4): 20.42
Polar Surface Area: 70 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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