ChemSpider 2D Image | 2-(4-Methoxyphenyl)-4-oxo-4H-chromene-3,5,7-triyl triacetate | C22H18O9

2-(4-Methoxyphenyl)-4-oxo-4H-chromene-3,5,7-triyl triacetate

  • Molecular FormulaC22H18O9
  • Average mass426.373 Da
  • Monoisotopic mass426.095093 Da
  • ChemSpider ID57428109

More details:

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

2-(4-Methoxyphenyl)-4-oxo-4H-chromen-3,5,7-triyl-triacetat [German] [ACD/IUPAC Name]
2-(4-Methoxyphenyl)-4-oxo-4H-chromene-3,5,7-triyl triacetate [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3,5,7-tris(acetyloxy)-2-(4-methoxyphenyl)- [ACD/Index Name]
Triacétate de 2-(4-méthoxyphényl)-4-oxo-4H-chromène-3,5,7-triyle [French] [ACD/IUPAC Name]
2-(4-Methoxyphenyl)-4-oxo-4H-1-benzopyran-3,5,7-triyl triacetate
38681-32-2 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 587.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 255.8±30.2 °C
Index of Refraction: 1.603
Molar Refractivity: 104.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.67
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 51.93
ACD/KOC (pH 5.5): 588.16
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.93
ACD/KOC (pH 7.4): 588.16
Polar Surface Area: 114 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 59.6±5.0 dyne/cm
Molar Volume: 303.8±5.0 cm3

Click to predict properties on the Chemicalize site


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