ChemSpider 2D Image | Methyl 3-[4-(methoxycarbonyl)phenyl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate | C21H16O7

Methyl 3-[4-(methoxycarbonyl)phenyl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate

  • Molecular FormulaC21H16O7
  • Average mass380.348 Da
  • Monoisotopic mass380.089600 Da
  • ChemSpider ID28635562

More details:

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

3-[4-(Méthoxycarbonyl)phényl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromène-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
4H-Furo[3,2-c][1]benzopyran-2-carboxylic acid, 2,3-dihydro-3-[4-(methoxycarbonyl)phenyl]-4-oxo-, methyl ester [ACD/Index Name]
Methyl 3-[4-(methoxycarbonyl)phenyl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate [ACD/IUPAC Name]
Methyl-3-[4-(methoxycarbonyl)phenyl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromen-2-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: 564.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 248.5±30.2 °C
Index of Refraction: 1.633
Molar Refractivity: 95.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 579.25
ACD/KOC (pH 5.5): 3305.69
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 579.25
ACD/KOC (pH 7.4): 3305.69
Polar Surface Area: 88 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 60.7±5.0 dyne/cm
Molar Volume: 268.2±5.0 cm3

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