ChemSpider 2D Image | 3-Hydroxy-5-[(E)-2-(4-hydroxyphenyl)vinyl]phenyl 2-O-beta-D-glucopyranosyl-beta-D-xylopyranoside | C25H30O12

3-Hydroxy-5-[(E)-2-(4-hydroxyphenyl)vinyl]phenyl 2-O-β-D-glucopyranosyl-β-D-xylopyranoside

  • Molecular FormulaC25H30O12
  • Average mass522.498 Da
  • Monoisotopic mass522.173706 Da
  • ChemSpider ID24637048

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

2-O-β-D-Glucopyranosyl-β-D-xylopyranoside de 3-hydroxy-5-[(E)-2-(4-hydroxyphényl)vinyl]phényle [French] [ACD/IUPAC Name]
3-Hydroxy-5-[(E)-2-(4-hydroxyphenyl)vinyl]phenyl 2-O-β-D-glucopyranosyl-β-D-xylopyranoside [ACD/IUPAC Name]
3-Hydroxy-5-[(E)-2-(4-hydroxyphenyl)vinyl]phenyl-2-O-β-D-glucopyranosyl-β-D-xylopyranosid [German] [ACD/IUPAC Name]
β-D-Xylopyranoside, 3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl 2-O-β-D-glucopyranosyl- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 854.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.1±3.0 kJ/mol
Flash Point: 470.5±34.3 °C
Index of Refraction: 1.708
Molar Refractivity: 126.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -0.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.84
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.67
Polar Surface Area: 199 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 98.1±5.0 dyne/cm
Molar Volume: 324.4±5.0 cm3

Click to predict properties on the Chemicalize site


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