ChemSpider 2D Image | 5-Deoxy-4-C-[(1R)-1,2-dihydroxy(3-~2~H_1_)propyl]-2-C-(~2~H_1_)methyl-L-(5-~2~H_1_)arabinose | C9H15D3O6

5-Deoxy-4-C-[(1R)-1,2-dihydroxy(3-2H1)propyl]-2-C-(2H1)methyl-L-(5-2H1)arabinose

  • Molecular FormulaC9H15D3O6
  • Average mass225.254 Da
  • Monoisotopic mass225.129166 Da
  • ChemSpider ID67032455

  • defined stereocentres - 4 of 5 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

5-Deoxy-4-C-[(1R)-1,2-dihydroxy(3-2H1)propyl]-2-C-(2H1)methyl-L-(5-2H1)arabinose [ACD/IUPAC Name]
5-Desoxy-4-C-[(1R)-1,2-dihydroxy(3-2H1)propyl]-2-C-(2H1)methyl-L-(5-2H1)arabinose [German] [ACD/IUPAC Name]
5-Désoxy-4-C-[(1R)-1,2-dihydroxy(3-2H1)propyl]-2-C-(2H1)méthyl-L-(5-2H1)arabinose [French] [ACD/IUPAC Name]
D-gluco-Heptose-7-d, 7-deoxy-2,4-di-C-methyl-d-, (6ξ)- [ACD/Index Name]
2,4,6-trimethyl-d-glucose

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

Density: 1.4±0.1 g/cm3
Boiling Point: 481.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 86.0±6.0 kJ/mol
Flash Point: 259.3±25.2 °C
Index of Refraction: 1.543
Molar Refractivity: 51.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.12
ACD/LogD (pH 5.5): -1.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.67
ACD/LogD (pH 7.4): -1.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.67
Polar Surface Area: 118 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 66.0±3.0 dyne/cm
Molar Volume: 163.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement