ChemSpider 2D Image | 6,7-Dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-5-olate | C16H11O6

6,7-Dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-5-olate

  • Molecular FormulaC16H11O6
  • Average mass299.255 Da
  • Monoisotopic mass299.056122 Da
  • ChemSpider ID116079258

  • Charge - Charge

More details:

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

4H-1-Benzopyran-4-one, 5,6,7-trihydroxy-2-(4-methoxyphenyl)-, ion(1-) [ACD/Index Name]
6,7-Dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-5-olat [German] [ACD/IUPAC Name]
6,7-Dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-5-olate [ACD/IUPAC Name]
6,7-Dihydroxy-2-(4-méthoxyphényl)-4-oxo-4H-chromén-5-olate [French] [ACD/IUPAC Name]
ZINC14813963

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

Density:
Boiling Point: 596.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.2±3.0 kJ/mol
Flash Point: 228.2±23.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 100.32
ACD/KOC (pH 5.5): 890.02
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 4.66
ACD/KOC (pH 7.4): 41.32
Polar Surface Area: 99 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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