ChemSpider 2D Image | (2xi)-1,4,6-Tri-O-acetyl-2-chloro-2-deoxy-D-arabino-hexopyranose | C12H17ClO8

(2ξ)-1,4,6-Tri-O-acetyl-2-chloro-2-deoxy-D-arabino-hexopyranose

  • Molecular FormulaC12H17ClO8
  • Average mass324.712 Da
  • Monoisotopic mass324.061188 Da
  • ChemSpider ID74055338

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

(2ξ)-1,4,6-Tri-O-acetyl-2-chlor-2-desoxy-D-arabino-hexopyranose [German] [ACD/IUPAC Name]
(2ξ)-1,4,6-Tri-O-acetyl-2-chloro-2-deoxy-D-arabino-hexopyranose [ACD/IUPAC Name]
(2ξ)-1,4,6-Tri-O-acétyl-2-chloro-2-désoxy-D-arabino-hexopyranose [French] [ACD/IUPAC Name]
D-arabino-Hexopyranose, 2-chloro-2-deoxy-, 1,4,6-triacetate, (2ξ)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 434.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±6.0 kJ/mol
Flash Point: 216.5±28.7 °C
Index of Refraction: 1.498
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.06
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.51
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 32.51
Polar Surface Area: 108 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 48.8±5.0 dyne/cm
Molar Volume: 236.0±5.0 cm3

Click to predict properties on the Chemicalize site


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