ChemSpider 2D Image | 4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl alpha-L-galactopyranoside | C21H20O11

4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl α-L-galactopyranoside

  • Molecular FormulaC21H20O11
  • Average mass448.377 Da
  • Monoisotopic mass448.100555 Da
  • ChemSpider ID62450191

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl α-L-galactopyranoside [ACD/IUPAC Name]
4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl-α-L-galactopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-[4-(α-L-galactopyranosyloxy)-3-hydroxyphenyl]-5,7-dihydroxy- [ACD/Index Name]
α-L-Galactopyranoside de 4-(5,7-dihydroxy-4-oxo-4H-chromén-2-yl)-2-hydroxyphényle [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 814.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.1±3.0 kJ/mol
Flash Point: 288.5±27.8 °C
Index of Refraction: 1.740
Molar Refractivity: 105.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -0.06
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.38
ACD/LogD (pH 7.4): -1.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.58
Polar Surface Area: 186 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 100.8±3.0 dyne/cm
Molar Volume: 261.6±3.0 cm3

Click to predict properties on the Chemicalize site


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