ChemSpider 2D Image | Methyl 6-ethyl-7-methoxy-1-oxo-1,3-dihydro-2-benzofuran-5-carboxylate | C13H14O5

Methyl 6-ethyl-7-methoxy-1-oxo-1,3-dihydro-2-benzofuran-5-carboxylate

  • Molecular FormulaC13H14O5
  • Average mass250.247 Da
  • Monoisotopic mass250.084122 Da
  • ChemSpider ID30659564

More details:

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

5-Isobenzofurancarboxylic acid, 6-ethyl-1,3-dihydro-7-methoxy-1-oxo-, methyl ester [ACD/Index Name]
6-Éthyl-7-méthoxy-1-oxo-1,3-dihydro-2-benzofurane-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-ethyl-7-methoxy-1-oxo-1,3-dihydro-2-benzofuran-5-carboxylate [ACD/IUPAC Name]
Methyl-6-ethyl-7-methoxy-1-oxo-1,3-dihydro-2-benzofuran-5-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 446.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 201.7±28.8 °C
Index of Refraction: 1.546
Molar Refractivity: 63.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 38.20
ACD/KOC (pH 5.5): 472.11
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 38.20
ACD/KOC (pH 7.4): 472.11
Polar Surface Area: 62 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 200.8±3.0 cm3

Click to predict properties on the Chemicalize site


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