ChemSpider 2D Image | 3,4,6-Tri-O-acetyl-2-{[4-(benzyloxy)benzoyl]amino}-2-deoxy-1-O-(phenylacetyl)hexopyranose | C34H35NO11

3,4,6-Tri-O-acetyl-2-{[4-(benzyloxy)benzoyl]amino}-2-deoxy-1-O-(phenylacetyl)hexopyranose

  • Molecular FormulaC34H35NO11
  • Average mass633.642 Da
  • Monoisotopic mass633.221008 Da
  • ChemSpider ID3413858

More details:

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

3,4,6-Tri-O-acetyl-2-{[4-(benzyloxy)benzoyl]amino}-2-deoxy-1-O-(phenylacetyl)hexopyranose [ACD/IUPAC Name]
3,4,6-Tri-O-acétyl-2-{[4-(benzyloxy)benzoyl]amino}-2-désoxy-1-O-(2-phénylacétyl)hexopyranose [French] [ACD/IUPAC Name]
3,4,6-Tri-O-acetyl-2-{[4-(benzyloxy)benzoyl]amino}-2-desoxy-1-O-(phenylacetyl)hexopyranose [German] [ACD/IUPAC Name]
Hexopyranose, 2-deoxy-2-[[4-(phenylmethoxy)benzoyl]amino]-, 3,4,6-triacetate 1-(2-phenylacetate) [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: 759.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.6±3.0 kJ/mol
Flash Point: 413.0±32.9 °C
Index of Refraction: 1.594
Molar Refractivity: 162.8±0.4 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 6.03
ACD/LogD (pH 5.5): 4.78
ACD/BCF (pH 5.5): 2524.51
ACD/KOC (pH 5.5): 9481.43
ACD/LogD (pH 7.4): 4.78
ACD/BCF (pH 7.4): 2524.43
ACD/KOC (pH 7.4): 9481.12
Polar Surface Area: 153 Å2
Polarizability: 64.5±0.5 10-24cm3
Surface Tension: 58.5±5.0 dyne/cm
Molar Volume: 479.9±5.0 cm3

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