ChemSpider 2D Image | 1,3,4-Tris-O-[(~2~H_1_)methyl]-D-fructose | C9H15D3O6

1,3,4-Tris-O-[(2H1)methyl]-D-fructose

  • Molecular FormulaC9H15D3O6
  • Average mass225.254 Da
  • Monoisotopic mass225.129166 Da
  • ChemSpider ID67030204

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1,3,4-Tris-O-[(2H1)methyl]-D-fructose [German] [ACD/IUPAC Name]
1,3,4-Tris-O-[(2H1)methyl]-D-fructose [ACD/IUPAC Name]
1,3,4-Tris-O-[(2H1)méthyl]-D-fructose [French] [ACD/IUPAC Name]
D-Fructose, 1,3,4-tri-O-methyl-d- [ACD/Index Name]
1,3,4-tri-O-methyl-d-fructose

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

Density: 1.2±0.1 g/cm3
Boiling Point: 364.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.7±6.0 kJ/mol
Flash Point: 139.5±21.4 °C
Index of Refraction: 1.461
Molar Refractivity: 52.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.62
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.56
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.56
Polar Surface Area: 85 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 189.4±3.0 cm3

Click to predict properties on the Chemicalize site


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