ChemSpider 2D Image | 5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl alpha-L-erythro-hexopyranoside | C22H22O10

5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl α-L-erythro-hexopyranoside

  • Molecular FormulaC22H22O10
  • Average mass446.404 Da
  • Monoisotopic mass446.121307 Da
  • ChemSpider ID24843485

  • 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, 7-(α-L-erythro-hexopyranosyloxy)-5-hydroxy-2-(4-methoxyphenyl)- [ACD/Index Name]
5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl α-L-erythro-hexopyranoside [ACD/IUPAC Name]
5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl-α-L-erythro-hexopyranosid [German] [ACD/IUPAC Name]
α-L-érythro-Hexopyranoside de 5-hydroxy-2-(4-méthoxyphényl)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 754.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.4±3.0 kJ/mol
Flash Point: 265.5±26.4 °C
Index of Refraction: 1.675
Molar Refractivity: 108.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 0.66
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.44
ACD/KOC (pH 5.5): 42.35
ACD/LogD (pH 7.4): -0.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.58
Polar Surface Area: 155 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 77.7±3.0 dyne/cm
Molar Volume: 288.8±3.0 cm3

Click to predict properties on the Chemicalize site


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