ChemSpider 2D Image | 2,4,6-Trimethoxyphenyl beta-D-allopyranoside | C15H22O9

2,4,6-Trimethoxyphenyl β-D-allopyranoside

  • Molecular FormulaC15H22O9
  • Average mass346.330 Da
  • Monoisotopic mass346.126373 Da
  • ChemSpider ID114812973

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,4,6-Trimethoxyphenyl β-D-allopyranoside [ACD/IUPAC Name]
2,4,6-Trimethoxyphenyl-β-D-allopyranosid [German] [ACD/IUPAC Name]
β-D-Allopyranoside de 2,4,6-triméthoxyphényle [French] [ACD/IUPAC Name]
β-D-Allopyranoside, 2,4,6-trimethoxyphenyl [ACD/Index 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: 558.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 291.6±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 82.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.84
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.08
ACD/LogD (pH 7.4): -1.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.08
Polar Surface Area: 127 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 248.5±3.0 cm3

Click to predict properties on the Chemicalize site


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