ChemSpider 2D Image | (2R,3R)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl beta-D-erythro-hexopyranoside | C21H24O10

(2R,3R)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl β-D-erythro-hexopyranoside

  • Molecular FormulaC21H24O10
  • Average mass436.409 Da
  • Monoisotopic mass436.136932 Da
  • ChemSpider ID24842508

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

(2R,3R)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl β-D-erythro-hexopyranoside [ACD/IUPAC Name]
(2R,3R)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl-β-D-erythro-hexopyranosid [German] [ACD/IUPAC Name]
β-D-érythro-Hexopyranoside de (2R,3R)-5,7-dihydroxy-2-(4-hydroxyphényl)-3,4-dihydro-2H-chromén-3-yle [French] [ACD/IUPAC Name]
β-D-erythro-Hexopyranoside, (2R,3R)-3,4-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-2H-1-benzopyran-3-yl [ACD/Index 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: 776.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.5±3.0 kJ/mol
Flash Point: 423.1±32.9 °C
Index of Refraction: 1.733
Molar Refractivity: 104.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -0.96
ACD/LogD (pH 5.5): -0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.59
ACD/LogD (pH 7.4): -0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.42
Polar Surface Area: 169 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 104.9±5.0 dyne/cm
Molar Volume: 261.8±5.0 cm3

Click to predict properties on the Chemicalize site


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