ChemSpider 2D Image | 2-Deoxy-4-O-(4-deoxy-2-O-sulfohex-4-enopyranuronosyl)-6-O-sulfo-2-(sulfoamino)hexopyranose | C12H19NO19S3

2-Deoxy-4-O-(4-deoxy-2-O-sulfohex-4-enopyranuronosyl)-6-O-sulfo-2-(sulfoamino)hexopyranose

  • Molecular FormulaC12H19NO19S3
  • Average mass577.470 Da
  • Monoisotopic mass576.971313 Da
  • ChemSpider ID323035

More details:

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

2-Deoxy-4-O-(4-deoxy-2-O-sulfohex-4-enopyranuronosyl)-6-O-sulfo-2-(sulfoamino)hexopyranose [ACD/IUPAC Name]
2-Desoxy-4-O-(4-desoxy-2-O-sulfohex-4-enopyranuronosyl)-6-O-sulfo-2-(sulfoamino)hexopyranose [German] [ACD/IUPAC Name]
2-Désoxy-4-O-(4-désoxy-2-O-sulfohex-4-énopyranuronosyl)-6-O-sulfo-2-(sulfoamino)hexopyranose [French] [ACD/IUPAC Name]
Hexopyranose, 2-deoxy-4-O-(4-deoxy-2-O-sulfohex-4-enopyranuronosyl)-2-(sulfoamino)-, 6-(hydrogen sulfate) [ACD/Index Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.714
Molar Refractivity: 102.7±0.4 cm3
#H bond acceptors: 20
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -1.90
ACD/LogD (pH 5.5): -10.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 344 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 147.8±5.0 dyne/cm
Molar Volume: 261.7±5.0 cm3

Click to predict properties on the Chemicalize site


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