ChemSpider 2D Image | 2-[(~2~H_3_)Methyloxy]phenyl beta-D-glucopyranoside | C13H15D3O7

2-[(2H3)Methyloxy]phenyl β-D-glucopyranoside

  • Molecular FormulaC13H15D3O7
  • Average mass289.296 Da
  • Monoisotopic mass289.124084 Da
  • ChemSpider ID82827141

  • defined stereocentres - 5 of 5 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2-[(2H3)Methyloxy]phenyl β-D-glucopyranoside [ACD/IUPAC Name]
2-[(2H3)Methyloxy]phenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de 2-[(2H3)méthyloxy]phényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 2-(methyl-d3-oxy)phenyl [ACD/Index Name]
1208109-55-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 496.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.5±3.0 kJ/mol
Flash Point: 254.1±28.7 °C
Index of Refraction: 1.600
Molar Refractivity: 68.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.04
ACD/LogD (pH 5.5): -0.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.52
ACD/LogD (pH 7.4): -0.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.52
Polar Surface Area: 109 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 200.5±3.0 cm3

Click to predict properties on the Chemicalize site


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