ChemSpider 2D Image | 5,7-Dihydroxy-4-oxo-2-phenyl-4H-chromen-6-yl beta-D-threo-hexopyranoside | C21H20O10

5,7-Dihydroxy-4-oxo-2-phenyl-4H-chromen-6-yl β-D-threo-hexopyranoside

  • Molecular FormulaC21H20O10
  • Average mass432.378 Da
  • Monoisotopic mass432.105652 Da
  • ChemSpider ID24844025
  • defined stereocentres - 3 of 5 defined stereocentres


More details:






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

4H-1-Benzopyran-4-one, 6-(β-D-threo-hexopyranosyloxy)-5,7-dihydroxy-2-phenyl- [ACD/Index Name]
5,7-Dihydroxy-4-oxo-2-phenyl-4H-chromen-6-yl β-D-threo-hexopyranoside [ACD/IUPAC Name]
5,7-Dihydroxy-4-oxo-2-phenyl-4H-chromen-6-yl-β-D-threo-hexopyranosid [German] [ACD/IUPAC Name]
β-D-thréo-Hexopyranoside de 5,7-dihydroxy-4-oxo-2-phényl-4H-chromén-6-yle [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: 783.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.6±3.0 kJ/mol
Flash Point: 278.9±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: -0.43
ACD/LogD (pH 5.5): -0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.42
ACD/LogD (pH 7.4): -2.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
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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