ChemSpider 2D Image | tetraacetylchitotetraose | C32H54N4O21

tetraacetylchitotetraose

  • Molecular FormulaC32H54N4O21
  • Average mass830.785 Da
  • Monoisotopic mass830.328064 Da
  • ChemSpider ID9160890

  • defined stereocentres - 19 of 20 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-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-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-D-glucopyranose [French] [ACD/IUPAC Name]
chitotetraose, tetra-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)-2-(acetylamino)-2- ;deoxy- [ACD/Index Name]
tetraacetylchitotetraose
Tetra-N-acetylchitotetraose
?-D-GlcNAc-(1->4)-?-D-GlcNAc-(1->4)-?-D-GlcNAc-(1->4)-D-GlcNAc
2706-65-2 [RN]
2-Acetamido-2-deoxy-?-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-?-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-?-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose
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  • Miscellaneous

    • Chemical Class:

      An amino tetrasaccharide consisting of three 2-acetamido-2-deoxy-beta-D-glucopyranose residues and a 2-acetamido-2-deoxy-D-glucopyranose residue joined in sequence by (1->4) glycosidic bonds. ChEBI CHEBI:143142

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

Density: 1.6±0.1 g/cm3
Boiling Point: 1329.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 225.4±6.0 kJ/mol
Flash Point: 757.8±34.3 °C
Index of Refraction: 1.629
Molar Refractivity: 184.2±0.4 cm3
#H bond acceptors: 25
#H bond donors: 14
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -3.44
ACD/LogD (pH 5.5): -4.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 383 Å2
Polarizability: 73.0±0.5 10-24cm3
Surface Tension: 90.7±5.0 dyne/cm
Molar Volume: 518.3±5.0 cm3

Click to predict properties on the Chemicalize site


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