ChemSpider 2D Image | 2-Acetyl-3-methylphenyl beta-D-glucopyranoside | C15H20O7

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

  • Molecular FormulaC15H20O7
  • Average mass312.315 Da
  • Monoisotopic mass312.120911 Da
  • ChemSpider ID29814567

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-Acetyl-3-methylphenyl β-D-glucopyranoside [ACD/IUPAC Name]
2-Acetyl-3-methylphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Ethanone, 1-[2-(β-D-glucopyranosyloxy)-6-methylphenyl]- [ACD/Index Name]
β-D-Glucopyranoside de 2-acétyl-3-méthylphényle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 546.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 203.2±23.6 °C
Index of Refraction: 1.601
Molar Refractivity: 76.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.95
ACD/LogD (pH 5.5): -0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.38
ACD/LogD (pH 7.4): -0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.38
Polar Surface Area: 116 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 224.3±3.0 cm3

Click to predict properties on the Chemicalize site


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