ChemSpider 2D Image | 9-Amino-N-acetylneuraminic acid | C11H20N2O8

9-Amino-N-acetylneuraminic acid

  • Molecular FormulaC11H20N2O8
  • Average mass308.285 Da
  • Monoisotopic mass308.121979 Da
  • ChemSpider ID32820971

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(6R)-5-Acetamido-6-[(1R,2R)-3-amino-1,2-dihydroxypropyl]-3,5-dideoxy-L-threo-hex-2-ulopyranosonic acid [ACD/IUPAC Name]
(6R)-5-Acetamido-6-[(1R,2R)-3-amino-1,2-dihydroxypropyl]-3,5-didesoxy-L-threo-hex-2-ulopyranosonsäure [German] [ACD/IUPAC Name]
(6R)-6-[(1R,2R)-3-Amino-1,2-dihydroxypropyl]-3,5-dideoxy-5-[(Z)-(1-hydroxyethylidene)amino]-L-threo-hex-2-ulopyranosonic acid [ACD/IUPAC Name]
(6R)-6-[(1R,2R)-3-Amino-1,2-dihydroxypropyl]-3,5-didesoxy-5-[(Z)-(1-hydroxyethyliden)amino]-L-threo-hex-2-ulopyranosonsäure [German] [ACD/IUPAC Name]
112037-47-5 [RN]
9-Amino-N-acetylneuraminic acid
Acide (6R)-5-acétamido-6-[(1R,2R)-3-amino-1,2-dihydroxypropyl]-3,5-didésoxy-L-thréo-hex-2-ulopyranosonique [French] [ACD/IUPAC Name]
Acide (6R)-6-[(1R,2R)-3-amino-1,2-dihydroxypropyl]-3,5-didésoxy-5-[(Z)-(1-hydroxyéthylidène)amino]-L-thréo-hex-2-ulopyranosonique [French] [ACD/IUPAC Name]
D-glycero-D-galacto-2-Nonulopyranosonic acid, 5-(acetylamino)-9-amino-3,5,9-trideoxy- [ACD/Index Name]
D-glycero-D-galacto-2-Nonulopyranosonic acid, 9-amino-3,5,9-trideoxy-5-[[(1Z)-1-hydroxyethylidene]amino]- [ACD/Index Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 778.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±6.1 mmHg at 25°C
    Enthalpy of Vaporization: 129.1±6.0 kJ/mol
    Flash Point: 424.6±32.9 °C
    Index of Refraction: 1.615
    Molar Refractivity: 67.8±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 8
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 2
    ACD/LogP: -2.78
    ACD/LogD (pH 5.5): -5.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.21
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 183 Å2
    Polarizability: 26.9±0.5 10-24cm3
    Surface Tension: 91.6±5.0 dyne/cm
    Molar Volume: 194.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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