ChemSpider 2D Image | 5,7,8-Trihydroxy-6-methoxy-2H-chromen-2-one | C10H8O6

5,7,8-Trihydroxy-6-methoxy-2H-chromen-2-one

  • Molecular FormulaC10H8O6
  • Average mass224.167 Da
  • Monoisotopic mass224.032089 Da
  • ChemSpider ID58779880

More details:

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

2H-1-Benzopyran-2-one, 5,7,8-trihydroxy-6-methoxy- [ACD/Index Name]
5,7,8-Trihydroxy-6-methoxy-2H-chromen-2-on [German] [ACD/IUPAC Name]
5,7,8-Trihydroxy-6-methoxy-2H-chromen-2-one [ACD/IUPAC Name]
5,7,8-Trihydroxy-6-méthoxy-2H-chromén-2-one [French] [ACD/IUPAC Name]
2177290-23-0 [RN]
5,7,8-trihydroxy-6-methoxy-2-benzopyrone
5,7,8-trihydroxy-6-methoxycoumarin
5-hydroxyfraxetin
C22007
Sideretin
More...
  • Miscellaneous

    • Chemical Class:

      A hydroxycoumarin that is fraxetin which has been substituted by an additional hydroxy group at positions 5. It is the primary molecule exuded by Arabidopsis thaliana roots in response to iron deficie ncy. ChEBI CHEBI:142095
      A hydroxycoumarin that is fraxetin which has been substituted by an additional hydroxy group at positions 5. It is the primary molecule exuded by Arabidopsis thaliana roots in response to; iron defic iency. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:142095

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

Density: 1.6±0.1 g/cm3
Boiling Point: 544.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 224.5±23.6 °C
Index of Refraction: 1.689
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.44
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.25
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.19
Polar Surface Area: 96 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 81.6±3.0 dyne/cm
Molar Volume: 136.4±3.0 cm3

Click to predict properties on the Chemicalize site


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