ChemSpider 2D Image | 4-Allyl-2-methoxyphenyl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside | C21H30O11

4-Allyl-2-methoxyphenyl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside

  • Molecular FormulaC21H30O11
  • Average mass458.456 Da
  • Monoisotopic mass458.178802 Da
  • ChemSpider ID58829876

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

4-Allyl-2-methoxyphenyl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside [ACD/IUPAC Name]
4-Allyl-2-methoxyphenyl-6-O-β-D-xylopyranosyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-β-D-Xylopyranosyl-β-D-glucopyranoside de 4-allyl-2-méthoxyphényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 2-methoxy-4-(2-propen-1-yl)phenyl 6-O-β-D-xylopyranosyl- [ACD/Index Name]
eugenol &β;-primeveroside
eugenol <i>O&lt;/i>-&β;-&lt;i>D</i>-xylopyranosyl-(1-&gt;6)-<i>O<;/i>-&β;-<;i>D</i>-glucopyranoside
eugenyl &β;-primeveroside
eugenyl &β;-primeveroside|sasanquin|eugenol &β;-primeveroside|eugenyl-GX|eugenyl 6-<i>O</i>-&amp;β;-<i>D<;/i>-xylopyranosyl-1-&β;-<i&gt;D</i>-glucopyranoside
eugenyl 6-<i>O</i>-&β;-<i>D</i&gt;-xylopyranosyl-&amp;β;-<i>D<;/i>-glucopyranoside
eugenyl 6-<i>O</i>-&β;-<i>D</i&gt;-xylopyranosyl-1-&β;-<i>D&lt;/i>-glucopyranoside
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 692.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 372.5±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 109.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.18
ACD/LogD (pH 5.5): -0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.84
ACD/LogD (pH 7.4): -0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.84
Polar Surface Area: 168 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 74.4±5.0 dyne/cm
Molar Volume: 312.1±5.0 cm3

Click to predict properties on the Chemicalize site


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