ChemSpider 2D Image | Methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(hexopyranosyloxy)-4-oxo-4H-chromene-2-carboxylate | C25H24O12

Methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(hexopyranosyloxy)-4-oxo-4H-chromene-2-carboxylate

  • Molecular FormulaC25H24O12
  • Average mass516.451 Da
  • Monoisotopic mass516.126770 Da
  • ChemSpider ID2851701

More details:

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

3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-7-(hexopyranosyloxy)-4-oxo-4H-chromène-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
4H-1-Benzopyran-2-carboxylic acid, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(hexopyranosyloxy)-4-oxo-, methyl ester [ACD/Index Name]
Methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(hexopyranosyloxy)-4-oxo-4H-chromene-2-carboxylate [ACD/IUPAC Name]
Methyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(hexopyranosyloxy)-4-oxo-4H-chromen-2-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 765.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 117.0±3.0 kJ/mol
Flash Point: 261.5±26.4 °C
Index of Refraction: 1.656
Molar Refractivity: 121.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -0.01
ACD/LogD (pH 5.5): 0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.55
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.55
Polar Surface Area: 170 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 74.8±3.0 dyne/cm
Molar Volume: 330.9±3.0 cm3

Click to predict properties on the Chemicalize site


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