ChemSpider 2D Image | 2-Acetamido-2-deoxy-alpha-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucose | C32H54N4O21

2-Acetamido-2-deoxy-α-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucose

  • Molecular FormulaC32H54N4O21
  • Average mass830.785 Da
  • Monoisotopic mass830.328064 Da
  • ChemSpider ID114813534

  • defined stereocentres - 19 of 19 defined stereocentres

More details:

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

2-Acetamido-2-deoxy-α-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-α-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-allopyranosyl-(1->;4)-2-acetamido-2-desoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-desoxy-D-glucose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-α-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-allopyranosyl-(1->;4)-2-acétamido-2-désoxy-β-D-allopyranosyl-(1->4)-2-acétamido-2-désoxy-D-glucose [French] [ACD/IUPAC Name]
D-Glucose, O-2-(acetylamino)-2-deoxy-α-D-glucopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-allopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-allopyranosyl-(1->4)-2-(acetylamino)-2-deoxy- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 1334.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 226.4±6.0 kJ/mol
Flash Point: 761.0±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 184.9±0.4 cm3
#H bond acceptors: 25
#H bond donors: 14
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: -3.41
ACD/LogD (pH 5.5): -4.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 391 Å2
Polarizability: 73.3±0.5 10-24cm3
Surface Tension: 88.9±5.0 dyne/cm
Molar Volume: 527.5±5.0 cm3

Click to predict properties on the Chemicalize site


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