ChemSpider 2D Image | 4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl beta-L-glycero-hexopyranoside | C21H20O10

4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl β-L-glycero-hexopyranoside

  • Molecular FormulaC21H20O10
  • Average mass432.378 Da
  • Monoisotopic mass432.105652 Da
  • ChemSpider ID24842755

  • defined stereocentres - 2 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-3-yl)phenyl β-L-glycero-hexopyranoside [ACD/IUPAC Name]
4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl-β-L-glycero-hexopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[4-(β-L-glycero-hexopyranosyloxy)phenyl]-5,7-dihydroxy- [ACD/Index Name]
β-L-glycéro-Hexopyranoside de 4-(5,7-dihydroxy-4-oxo-4H-chromén-3-yl)phényle [French] [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: 763.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.6±3.0 kJ/mol
Flash Point: 271.5±26.4 °C
Index of Refraction: 1.717
Molar Refractivity: 103.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.31
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.49
ACD/KOC (pH 5.5): 44.29
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.68
Polar Surface Area: 166 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 91.4±3.0 dyne/cm
Molar Volume: 263.2±3.0 cm3

Click to predict properties on the Chemicalize site


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