ChemSpider 2D Image | 3-O-Undecyl-D-glucopyranose | C17H34O6

3-O-Undecyl-D-glucopyranose

  • Molecular FormulaC17H34O6
  • Average mass334.448 Da
  • Monoisotopic mass334.235535 Da
  • ChemSpider ID23267107

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

3-O-Undecyl-D-glucopyranose [ACD/IUPAC Name]
3-O-Undecyl-D-glucopyranose [German] [ACD/IUPAC Name]
3-O-Undécyl-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, 3-O-undecyl- [ACD/Index Name]
(3R,4S,5R,6R)-6-(hydroxymethyl)-4-(undecyloxy)-tetrahydro-2H-pyran-2,3,5-triol
CHEMBL383746
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL383746/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 496.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.1±6.0 kJ/mol
Flash Point: 254.3±28.7 °C
Index of Refraction: 1.510
Molar Refractivity: 88.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 2.64
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.88
ACD/KOC (pH 5.5): 778.87
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.88
ACD/KOC (pH 7.4): 778.85
Polar Surface Area: 99 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 48.9±5.0 dyne/cm
Molar Volume: 294.9±5.0 cm3

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