ChemSpider 2D Image | Methyl 2-hydroxy-6-{2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetoxy}benzoate | C25H18O9

Methyl 2-hydroxy-6-{2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetoxy}benzoate

  • Molecular FormulaC25H18O9
  • Average mass462.405 Da
  • Monoisotopic mass462.095093 Da
  • ChemSpider ID26391348

More details:






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

2-Hydroxy-6-{2-[(5-hydroxy-4-oxo-2-phényl-4H-chromén-7-yl)oxy]acétoxy}benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-hydroxy-6-[[2-[(5-hydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl)oxy]acetyl]oxy]-, methyl ester [ACD/Index Name]
Methyl 2-hydroxy-6-{2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetoxy}benzoate [ACD/IUPAC Name]
Methyl-2-hydroxy-6-{2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetoxy}benzoat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 686.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.3±3.0 kJ/mol
Flash Point: 237.2±25.0 °C
Index of Refraction: 1.654
Molar Refractivity: 117.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.53
ACD/LogD (pH 5.5): 4.64
ACD/BCF (pH 5.5): 1887.07
ACD/KOC (pH 5.5): 7261.65
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 117.26
ACD/KOC (pH 7.4): 451.24
Polar Surface Area: 129 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 320.0±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement