ChemSpider 2D Image | 2-(4-Methoxyphenyl)-4-oxo-4H-chromene-5,7,8-triyl triacetate | C22H18O9

2-(4-Methoxyphenyl)-4-oxo-4H-chromene-5,7,8-triyl triacetate

  • Molecular FormulaC22H18O9
  • Average mass426.373 Da
  • Monoisotopic mass426.095093 Da
  • ChemSpider ID28701654

More details:

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

2-(4-Methoxyphenyl)-4-oxo-4H-chromen-5,7,8-triyl-triacetat [German] [ACD/IUPAC Name]
2-(4-Methoxyphenyl)-4-oxo-4H-chromene-5,7,8-triyl triacetate [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 5,7,8-tris(acetyloxy)-2-(4-methoxyphenyl)- [ACD/Index Name]
Triacétate de 2-(4-méthoxyphényl)-4-oxo-4H-chromène-5,7,8-triyle [French] [ACD/IUPAC Name]
2-(4-Methoxyphenyl)-4-oxo-4H-1-benzopyran-5,7,8-triyl triacetate
89494-23-5 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 611.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 266.2±31.5 °C
Index of Refraction: 1.578
Molar Refractivity: 104.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 33.93
ACD/KOC (pH 5.5): 433.71
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 33.93
ACD/KOC (pH 7.4): 433.71
Polar Surface Area: 114 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 316.2±3.0 cm3

Click to predict properties on the Chemicalize site


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