ChemSpider 2D Image | 4-O-beta-D-Glucopyranosyl-D-(C~1~-~2~H_1_)glucitol | C12H23DO11

4-O-β-D-Glucopyranosyl-D-(C1-2H1)glucitol

  • Molecular FormulaC12H23DO11
  • Average mass345.319 Da
  • Monoisotopic mass345.138153 Da
  • ChemSpider ID9188570
  • defined stereocentres - 9 of 9 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

4-O-β-D-Glucopyranosyl-D-(C1-2H1)glucitol [ACD/IUPAC Name]
4-O-β-D-Glucopyranosyl-D-(C1-2H1)glucitol [German] [ACD/IUPAC Name]
4-O-β-D-Glucopyranosyl-D-(C1-2H1)glucitol [French] [ACD/IUPAC Name]
D-Glucitol-C1-d, 4-O-β-D-glucopyranosyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 788.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.2 mmHg at 25°C
Enthalpy of Vaporization: 130.7±6.0 kJ/mol
Flash Point: 430.7±32.9 °C
Index of Refraction: 1.634
Molar Refractivity: 72.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -5.14
ACD/LogD (pH 5.5): -4.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 201 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 109.2±5.0 dyne/cm
Molar Volume: 203.1±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement