ChemSpider 2D Image | 5-[(E)-2-(3,5-Dihydroxyphenyl)vinyl]-2-hydroxyphenyl beta-D-glucopyranoside | C20H22O9

5-[(E)-2-(3,5-Dihydroxyphenyl)vinyl]-2-hydroxyphenyl β-D-glucopyranoside

  • Molecular FormulaC20H22O9
  • Average mass406.383 Da
  • Monoisotopic mass406.126373 Da
  • ChemSpider ID23195660

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

5-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2-hydroxyphenyl β-D-glucopyranoside
5-[(E)-2-(3,5-Dihydroxyphenyl)vinyl]-2-hydroxyphenyl β-D-glucopyranoside [ACD/IUPAC Name]
5-[(E)-2-(3,5-Dihydroxyphenyl)vinyl]-2-hydroxyphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de 5-[(E)-2-(3,5-dihydroxyphényl)vinyl]-2-hydroxyphényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 5-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2-hydroxyphenyl [ACD/Index Name]
(2S,3R,4S,5S,6R)-2-{5-[(E)-2-(3,5-Dihydroxy-phenyl)-vinyl]-2-hydroxy-phenoxy}-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol
2-(3-(6-Methylpyridin-2-yl)-1H-pyrazol-4-yl)-1,5-naphthyridine
5-[(1E)-2-(3,5-Dihydroxyphenyl)ethenyl]-2-hydroxyphenyl β-D-glucopyranoside
94356-26-0 [RN]
MFCD28100371
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 721.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.7±3.0 kJ/mol
Flash Point: 390.2±32.9 °C
Index of Refraction: 1.761
Molar Refractivity: 105.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.04
ACD/LogD (pH 5.5): -0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.99
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.32
Polar Surface Area: 160 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 86.1±3.0 dyne/cm
Molar Volume: 255.0±3.0 cm3

Click to predict properties on the Chemicalize site


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