ChemSpider 2D Image | N-Hexanoyl-D-glucosamine | C12H23NO6

N-Hexanoyl-D-glucosamine

  • Molecular FormulaC12H23NO6
  • Average mass277.314 Da
  • Monoisotopic mass277.152527 Da
  • ChemSpider ID19115703

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

19817-88-0 [RN]
2-Deoxy-2-(hexanoylamino)-D-glucopyranose [ACD/IUPAC Name]
2-Desoxy-2-(hexanoylamino)-D-glucopyranose [German] [ACD/IUPAC Name]
2-Désoxy-2-(hexanoylamino)-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, 2-deoxy-2-[(1-oxohexyl)amino]- [ACD/Index Name]
N-Hexanoyl-D-glucosamine
[19817-88-0] [RN]
13996-79-7 [RN]
MFCD00059806
N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]hexanamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 578.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.6 mmHg at 25°C
    Enthalpy of Vaporization: 99.4±6.0 kJ/mol
    Flash Point: 303.8±30.1 °C
    Index of Refraction: 1.545
    Molar Refractivity: 67.1±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 5
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: -0.35
    ACD/LogD (pH 5.5): -0.11
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 20.72
    ACD/LogD (pH 7.4): -0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 20.72
    Polar Surface Area: 119 Å2
    Polarizability: 26.6±0.5 10-24cm3
    Surface Tension: 61.0±5.0 dyne/cm
    Molar Volume: 212.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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