ChemSpider 2D Image | (2S)-5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-acetyl-beta-D-threo-hexopyranoside | C23H24O11

(2S)-5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-acetyl-β-D-threo-hexopyranoside

  • Molecular FormulaC23H24O11
  • Average mass476.430 Da
  • Monoisotopic mass476.131866 Da
  • ChemSpider ID24846374

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

(2S)-5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-acetyl-β-D-threo-hexopyranoside [ACD/IUPAC Name]
(2S)-5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl-6-O-acetyl-β-D-threo-hexopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 7-[(6-O-acetyl-β-D-threo-hexopyranosyl)oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)- [ACD/Index Name]
6-O-Acétyl-β-D-thréo-hexopyranoside de (2S)-5-hydroxy-2-(4-hydroxyphényl)-4-oxo-3,4-dihydro-2H-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: 784.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.8±3.0 kJ/mol
Flash Point: 272.1±26.4 °C
Index of Refraction: 1.651
Molar Refractivity: 113.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 7.95
ACD/KOC (pH 5.5): 152.54
ACD/LogD (pH 7.4): 1.07
ACD/BCF (pH 7.4): 3.00
ACD/KOC (pH 7.4): 57.58
Polar Surface Area: 172 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 75.5±3.0 dyne/cm
Molar Volume: 310.9±3.0 cm3

Click to predict properties on the Chemicalize site


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