ChemSpider 2D Image | 6-Deoxyhexopyranosyl-(1->4)-[6-deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)]-2-acetamido-2-deoxyhexopyranose | C26H45NO19

6-Deoxyhexopyranosyl-(1->4)-[6-deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)]-2-acetamido-2-deoxyhexopyranose

  • Molecular FormulaC26H45NO19
  • Average mass675.631 Da
  • Monoisotopic mass675.258606 Da
  • ChemSpider ID21395894

More details:

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

6-Deoxyhexopyranosyl-(1->4)-[6-deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)]-2-acetamido-2-deoxyhexopyranose [ACD/IUPAC Name]
6-Desoxyhexopyranosyl-(1->4)-[6-desoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)]-2-acetamido-2-desoxyhexopyranose [German] [ACD/IUPAC Name]
6-Désoxyhexopyranosyl-(1->4)-[6-désoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)]-2-acétamido-2-désoxyhexopyranose [French] [ACD/IUPAC Name]
Hexopyranose, O--6-deoxyhexopyranosyl-(1->4)-O-[O--6-deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)]-2-(acetylamino)-2-deoxy- [ACD/Index Name]
80081-06-7 [RN]
Lewis B tetrasaccharide
LEWIS-B TETRASACCHARIDE

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1009.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 166.9±6.0 kJ/mol
Flash Point: 564.1±34.3 °C
Index of Refraction: 1.639
Molar Refractivity: 146.7±0.4 cm3
#H bond acceptors: 20
#H bond donors: 12
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.70
ACD/LogD (pH 7.4): -2.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.70
Polar Surface Area: 316 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 96.2±5.0 dyne/cm
Molar Volume: 407.4±5.0 cm3

Click to predict properties on the Chemicalize site


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