ChemSpider 2D Image | hexaacetyl-chitohexaose | C48H80N6O31

hexaacetyl-chitohexaose

  • Molecular FormulaC48H80N6O31
  • Average mass1237.170 Da
  • Monoisotopic mass1236.486816 Da
  • ChemSpider ID5293231

  • defined stereocentres - 29 of 30 defined stereocentres

More details:

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

2-Acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-ac ;etamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)- ;2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-D-glucopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)- ;2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-D-glucopyranose [French] [ACD/IUPAC Name]
38854-46-5 [RN]
Chitohexaose, hexa-N-acetyl
D-Glucopyranose, O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-O-2-(acetylamino)- ;2-deoxy-β-D-glucopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-2-(acetylamino)-2-deoxy- [ACD/Index Name]
hexaacetyl-chitohexaose
N,N,N,N,N,N-Hexaacetylchitohexaose
?-D-GlcNAc-(1->4)-?-D-GlcNAc-(1->4)-?-D-GlcNAc-(1->4)-?-D-GlcNAc-(1->4)-?-D-GlcNAc-(1->4)-D-GlcNAc
[38854-46-5] [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

H1396_SIGMA [DBID]

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

    Density: 1.6±0.0 g/cm3
    Boiling Point: 1648.3±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.0 mmHg at 25°C
    Enthalpy of Vaporization: 290.7±0.0 kJ/mol
    Flash Point: 950.7±0.0 °C
    Index of Refraction: 1.641
    Molar Refractivity: 274.7±0.0 cm3
    #H bond acceptors: 37
    #H bond donors: 20
    #Freely Rotating Bonds: 36
    #Rule of 5 Violations: 3
    ACD/LogP: -5.13
    ACD/LogD (pH 5.5): -5.13
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.13
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 559 Å2
    Polarizability: 108.9±0.0 10-24cm3
    Surface Tension: 95.2±0.0 dyne/cm
    Molar Volume: 761.2±0.0 cm3

    Click to predict properties on the Chemicalize site


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