ChemSpider 2D Image | 3-Deoxy-D-glycero-D-galacto-2-nonulosonic Acid | C9H16O9

3-Deoxy-D-glycero-D-galacto-2-nonulosonic Acid

  • Molecular FormulaC9H16O9
  • Average mass268.218 Da
  • Monoisotopic mass268.079437 Da
  • ChemSpider ID17215951
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

3-Deoxy-D-glycero-D-galacto-2-nonulosonic Acid
(4S,5R,6R,7R,8S)-4,5,6,7,8,9-Hexahydroxy-2-oxononanoic acid [ACD/IUPAC Name]
(4S,5R,6R,7R,8S)-4,5,6,7,8,9-Hexahydroxy-2-oxononansäure [German] [ACD/IUPAC Name]
22594-61-2 [RN]
Acide (4S,5R,6R,7R,8S)-4,5,6,7,8,9-hexahydroxy-2-oxononanoïque [French] [ACD/IUPAC Name]
L-glycero-D-galacto-2-Nonulosonic acid, 3-deoxy- [ACD/Index Name]
2-KDN
2-Oxo-3-deoxy-D-glycero-galactononulosonate
2-Oxo-3-deoxy-D-glycero-galactononulosonic acid
3-Deoxy-D-glycero-D-galacto-2-nonulosonate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 679.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.1±6.0 kJ/mol
Flash Point: 378.8±28.0 °C
Index of Refraction: 1.615
Molar Refractivity: 54.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -5.17
ACD/LogD (pH 5.5): -6.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 109.9±3.0 dyne/cm
Molar Volume: 155.8±3.0 cm3

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