ChemSpider 2D Image | (5xi)-3,4,6-Tri-O-acetyl-1,2-O-[(1S)-1-methoxyethylidene]-alpha-D-xylo-hexopyranose | C15H22O10

(5ξ)-3,4,6-Tri-O-acetyl-1,2-O-[(1S)-1-methoxyethylidene]-α-D-xylo-hexopyranose

  • Molecular FormulaC15H22O10
  • Average mass362.329 Da
  • Monoisotopic mass362.121307 Da
  • ChemSpider ID107441315

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(5ξ)-3,4,6-Tri-O-acetyl-1,2-O-[(1S)-1-methoxyethyliden]-α-D-xylo-hexopyranose [German] [ACD/IUPAC Name]
(5ξ)-3,4,6-Tri-O-acetyl-1,2-O-[(1S)-1-methoxyethylidene]-α-D-xylo-hexopyranose [ACD/IUPAC Name]
(5ξ)-3,4,6-Tri-O-acétyl-1,2-O-[(1S)-1-méthoxyéthylidène]-α-D-xylo-hexopyranose [French] [ACD/IUPAC Name]
α-D-xylo-Hexopyranose, 1,2-O-[(1S)-1-methoxyethylidene]-, triacetate, (5ξ)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 419.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 182.5±28.8 °C
Index of Refraction: 1.491
Molar Refractivity: 79.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 10.72
ACD/KOC (pH 5.5): 190.11
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 10.72
ACD/KOC (pH 7.4): 190.11
Polar Surface Area: 116 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 45.4±5.0 dyne/cm
Molar Volume: 275.8±5.0 cm3

Click to predict properties on the Chemicalize site


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