ChemSpider 2D Image | Benzyl 2-acetamido-4,6-O-benzylidene-2-deoxy-alpha-L-glucopyranoside | C22H25NO6

Benzyl 2-acetamido-4,6-O-benzylidene-2-deoxy-α-L-glucopyranoside

  • Molecular FormulaC22H25NO6
  • Average mass399.437 Da
  • Monoisotopic mass399.168182 Da
  • ChemSpider ID21504715
  • defined stereocentres - 5 of 6 defined stereocentres


More details:






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

2-Acétamido-4,6-O-benzylidène-2-désoxy-α-L-glucopyranoside de benzyle [French] [ACD/IUPAC Name]
Benzyl 2-acetamido-4,6-O-benzylidene-2-deoxy-α-L-glucopyranoside [ACD/IUPAC Name]
Benzyl-2-acetamido-4,6-O-benzyliden-2-desoxy-α-L-glucopyranosid [German] [ACD/IUPAC Name]
α-L-Glucopyranoside, phenylmethyl 2-(acetylamino)-2-deoxy-4,6-O-(phenylmethylene)- [ACD/Index Name]
N-[(4aS,6R,7S,8S,8aR)-6-(benzyloxy)-8-hydroxy-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl]acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 650.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.8±3.0 kJ/mol
Flash Point: 347.2±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 105.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 54.15
ACD/KOC (pH 5.5): 606.05
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 54.15
ACD/KOC (pH 7.4): 606.05
Polar Surface Area: 86 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 56.6±5.0 dyne/cm
Molar Volume: 305.7±5.0 cm3

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