ChemSpider 2D Image | 1,2,3,4-Tetra-O-acetyl-D-gluco-hexodialdo-1,5-pyranose | C14H18O10

1,2,3,4-Tetra-O-acetyl-D-gluco-hexodialdo-1,5-pyranose

  • Molecular FormulaC14H18O10
  • Average mass346.287 Da
  • Monoisotopic mass346.089996 Da
  • ChemSpider ID32689851

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

1,2,3,4-Tetra-O-acetyl-D-gluco-hexodialdo-1,5-pyranose [ACD/IUPAC Name]
1,2,3,4-Tétra-O-acétyl-D-gluco-hexodialdo-1,5-pyranose [French] [ACD/IUPAC Name]
D-gluco-Hexodialdo-1,5-pyranose, 1,2,3,4-tetraacetate [ACD/Index Name]
(2S,3S,4S,5R)-4,5,6-tris(acetyloxy)-2-formyloxan-3-yl acetate
(3R,4S,5S,6S)-6-; formyltetrahydro-2H-pyran-; 2,3,4,5-tetrayl tetraacetate
(3R,4S,5S,6S)-6-Formyltetrahydro-2H-pyran-2,3,4,5-tetrayl tetraacetate
67968-62-1 [RN]
MFCD28167081

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

Density: 1.3±0.1 g/cm3
Boiling Point: 408.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 178.4±28.8 °C
Index of Refraction: 1.483
Molar Refractivity: 74.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 3.35
ACD/KOC (pH 5.5): 82.62
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 3.35
ACD/KOC (pH 7.4): 82.62
Polar Surface Area: 132 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 47.6±5.0 dyne/cm
Molar Volume: 259.8±5.0 cm3

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