ChemSpider 2D Image | Methyl 2,3,6-tri-O-benzyl-4-O-(methylsulfonyl)-alpha-D-galactopyranoside | C29H34O8S

Methyl 2,3,6-tri-O-benzyl-4-O-(methylsulfonyl)-α-D-galactopyranoside

  • Molecular FormulaC29H34O8S
  • Average mass542.641 Da
  • Monoisotopic mass542.197449 Da
  • ChemSpider ID8160411

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,6-Tri-O-benzyl-4-O-(méthylsulfonyl)-α-D-galactopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 2,3,6-tri-O-benzyl-4-O-(methylsulfonyl)-α-D-galactopyranoside [ACD/IUPAC Name]
Methyl-2,3,6-tri-O-benzyl-4-O-(methylsulfonyl)-α-D-galactopyranosid [German] [ACD/IUPAC Name]
α-D-Galactopyranoside, methyl 2,3,6-tris-O-(phenylmethyl)-, methanesulfonate [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: 677.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 363.8±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 144.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.32
ACD/LogD (pH 5.5): 5.62
ACD/BCF (pH 5.5): 11041.50
ACD/KOC (pH 5.5): 27263.92
ACD/LogD (pH 7.4): 5.62
ACD/BCF (pH 7.4): 11041.50
ACD/KOC (pH 7.4): 27263.92
Polar Surface Area: 98 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 53.0±5.0 dyne/cm
Molar Volume: 427.8±5.0 cm3

Click to predict properties on the Chemicalize site


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