ChemSpider 2D Image | 2-Pyridinyl (2xi)-2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-1-thio-beta-L-arabino-hexopyranoside | C19H24N2O8S

2-Pyridinyl (2ξ)-2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-1-thio-β-L-arabino-hexopyranoside

  • Molecular FormulaC19H24N2O8S
  • Average mass440.467 Da
  • Monoisotopic mass440.125336 Da
  • ChemSpider ID68024248

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(2ξ)-2-Acétamido-3,4,6-tri-O-acétyl-2-désoxy-1-thio-β-L-arabino-hexopyranoside de 2-pyridinyle [French] [ACD/IUPAC Name]
2-Pyridinyl (2ξ)-2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-1-thio-β-L-arabino-hexopyranoside [ACD/IUPAC Name]
2-Pyridinyl-(2ξ)-2-acetamido-3,4,6-tri-O-acetyl-2-desoxy-1-thio-β-L-arabino-hexopyranosid [German] [ACD/IUPAC Name]
β-L-arabino-Hexopyranoside, 2-pyridinyl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate, (2ξ)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 625.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.8±31.5 °C
Index of Refraction: 1.558
Molar Refractivity: 106.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 1.28
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 4.58
ACD/KOC (pH 5.5): 103.44
ACD/LogD (pH 7.4): 1.17
ACD/BCF (pH 7.4): 4.59
ACD/KOC (pH 7.4): 103.51
Polar Surface Area: 155 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 56.3±5.0 dyne/cm
Molar Volume: 329.7±5.0 cm3

Click to predict properties on the Chemicalize site


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