ChemSpider 2D Image | deaminoneuraminic acid | C9H16O9

deaminoneuraminic acid

  • Molecular FormulaC9H16O9
  • Average mass268.218 Da
  • Monoisotopic mass268.079437 Da
  • ChemSpider ID28296211

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(6R)-3-Deoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-ulopyranosonic acid [ACD/IUPAC Name]
(6R)-3-Desoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-ulopyranosonsäure [German] [ACD/IUPAC Name]
153666-19-4 [RN]
Acide (6R)-3-désoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-thréo-hex-2-ulopyranosonique [French] [ACD/IUPAC Name]
deaminoneuraminic acid
D-glycero-D-galacto-2-Nonulopyranosonic acid, 3-deoxy- [ACD/Index Name]
(4S,5R,6R)-2,4,5-trihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
2-Keto-3-deoxy-D-glycero-D-galacto-nononic acid
3-Deoxy-6-(1,2,3-trihydroxypropyl)hex-2-ulopyranosonic acid [ACD/IUPAC Name]
3-deoxy-D-glycero-D-galacto-2-nonulopyranosonic acid
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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, version: 14.00

Density: 1.9±0.1 g/cm3
Boiling Point: 726.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.2±6.0 kJ/mol
Flash Point: 285.4±26.4 °C
Index of Refraction: 1.671
Molar Refractivity: 53.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -2.08
ACD/LogD (pH 5.5): -5.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 135.3±3.0 dyne/cm
Molar Volume: 144.1±3.0 cm3

Click to predict properties on the Chemicalize site


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