ChemSpider 2D Image | Methyl 7-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromene-5-carboxylate | C18H14O6

Methyl 7-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromene-5-carboxylate

  • Molecular FormulaC18H14O6
  • Average mass326.300 Da
  • Monoisotopic mass326.079041 Da
  • ChemSpider ID30836127

More details:

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

4H-1-Benzopyran-5-carboxylic acid, 7-hydroxy-2-(4-methoxyphenyl)-4-oxo-, methyl ester [ACD/Index Name]
7-Hydroxy-2-(4-méthoxyphényl)-4-oxo-4H-chromène-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 7-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromene-5-carboxylate [ACD/IUPAC Name]
Methyl-7-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-5-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 557.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 206.7±23.6 °C
Index of Refraction: 1.623
Molar Refractivity: 84.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 538.28
ACD/KOC (pH 5.5): 2984.81
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 40.09
ACD/KOC (pH 7.4): 222.29
Polar Surface Area: 82 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 239.6±3.0 cm3

Click to predict properties on the Chemicalize site


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