ChemSpider 2D Image | 2-Acetyl-5-hydroxy-3-methylphenyl beta-D-glucopyranoside | C15H20O8

2-Acetyl-5-hydroxy-3-methylphenyl β-D-glucopyranoside

  • Molecular FormulaC15H20O8
  • Average mass328.315 Da
  • Monoisotopic mass328.115814 Da
  • ChemSpider ID29814219

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-Acetyl-5-hydroxy-3-methylphenyl β-D-glucopyranoside [ACD/IUPAC Name]
2-Acetyl-5-hydroxy-3-methylphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Ethanone, 1-[2-(β-D-glucopyranosyloxy)-4-hydroxy-6-methylphenyl]- [ACD/Index Name]
β-D-Glucopyranoside de 2-acétyl-5-hydroxy-3-méthylphényle [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: 640.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 238.9±25.0 °C
Index of Refraction: 1.624
Molar Refractivity: 78.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.01
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.30
ACD/LogD (pH 7.4): -0.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.61
Polar Surface Area: 137 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 66.1±3.0 dyne/cm
Molar Volume: 222.8±3.0 cm3

Click to predict properties on the Chemicalize site


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