ChemSpider 2D Image | 9-Methoxy-7-oxo-7H-furo[3,2-g]chromen-4-olate | C12H7O5

9-Methoxy-7-oxo-7H-furo[3,2-g]chromen-4-olate

  • Molecular FormulaC12H7O5
  • Average mass231.182 Da
  • Monoisotopic mass231.029892 Da
  • ChemSpider ID31150537

  • Charge - Charge

More details:

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

7H-Furo[3,2-g][1]benzopyran-7-one, 4-hydroxy-9-methoxy-, ion(1-) [ACD/Index Name]
9-Methoxy-7-oxo-7H-furo[3,2-g]chromen-4-olat [German] [ACD/IUPAC Name]
9-Methoxy-7-oxo-7H-furo[3,2-g]chromen-4-olate [ACD/IUPAC Name]
9-Méthoxy-7-oxo-7H-furo[3,2-g]chromén-4-olate [French] [ACD/IUPAC Name]
5-hydroxyxanthotoxin
5-hydroxyxanthotoxin (OK)
5-hydroxyxanthotoxin(1-)
  • Miscellaneous

    • Chemical Class:

      A phenolate anion that is the conjugate base of 5-hydroxyxanthotoxin, obtained by deprotonation of the hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:78326

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

Density:
Boiling Point: 342.7±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.0±3.0 kJ/mol
Flash Point: 161.1±24.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 11.99
ACD/KOC (pH 5.5): 205.62
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 7.70
ACD/KOC (pH 7.4): 132.09
Polar Surface Area: 72 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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