ChemSpider 2D Image | Methyl 4,6-O-benzylidene-3-O-(2,3,4,6-tetra-O-acetyl-alpha-D-glucopyranosyl)-alpha-D-galactopyranoside | C28H36O15

Methyl 4,6-O-benzylidene-3-O-(2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl)-α-D-galactopyranoside

  • Molecular FormulaC28H36O15
  • Average mass612.576 Da
  • Monoisotopic mass612.205444 Da
  • ChemSpider ID9390712
  • defined stereocentres - 11 of 11 defined stereocentres


More details:






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

4,6-O-Benzylidène-3-O-(2,3,4,6-tétra-O-acétyl-α-D-glucopyranosyl)-α-D-galactopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 4,6-O-benzylidene-3-O-(2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl)-α-D-galactopyranoside [ACD/IUPAC Name]
Methyl-4,6-O-benzyliden-3-O-(2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl)-α-D-galactopyranosid [German] [ACD/IUPAC Name]
α-D-Galactopyranoside, methyl 4,6-O-(phenylmethylene)-3-O-(2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 684.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.5±3.0 kJ/mol
Flash Point: 216.8±25.0 °C
Index of Refraction: 1.552
Molar Refractivity: 141.7±0.4 cm3
#H bond acceptors: 15
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 147.43
ACD/KOC (pH 5.5): 1241.29
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 147.43
ACD/KOC (pH 7.4): 1241.28
Polar Surface Area: 181 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 443.3±5.0 cm3

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