ChemSpider 2D Image | 5-{3-[(2-Carboxy-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate | C23H15O11

5-{3-[(2-Carboxy-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate

  • Molecular FormulaC23H15O11
  • Average mass467.359 Da
  • Monoisotopic mass467.061981 Da
  • ChemSpider ID26331722
  • Charge - Charge


More details:






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

4H-1-Benzopyran-2-carboxylic acid, 5,5'-[(2-hydroxy-1,3-propanediyl)bis(oxy)]bis[4-oxo-, ion(1-) [ACD/Index Name]
5-{3-[(2-Carboxy-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromen-2-carboxylat [German] [ACD/IUPAC Name]
5-{3-[(2-Carboxy-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate [ACD/IUPAC Name]
5-{3-[(2-Carboxy-4-oxo-4H-chromén-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromène-2-carboxylate [French] [ACD/IUPAC Name]
cromoglycate(1-)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 752.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 263.9±26.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.30
ACD/LogD (pH 5.5): -2.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability:
Surface Tension:
Molar Volume:

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