ChemSpider 2D Image | 1,3,4,6-Tetra-O-acetyl-2-deoxy-2-{[3-(1H-indol-3-yl)propanoyl]amino}-beta-D-glucopyranose | C25H30N2O10

1,3,4,6-Tetra-O-acetyl-2-deoxy-2-{[3-(1H-indol-3-yl)propanoyl]amino}-β-D-glucopyranose

  • Molecular FormulaC25H30N2O10
  • Average mass518.513 Da
  • Monoisotopic mass518.190063 Da
  • ChemSpider ID76819036

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1,3,4,6-Tetra-O-acetyl-2-deoxy-2-{[3-(1H-indol-3-yl)propanoyl]amino}-β-D-glucopyranose [ACD/IUPAC Name]
1,3,4,6-Tetra-O-acetyl-2-desoxy-2-{[3-(1H-indol-3-yl)propanoyl]amino}-β-D-glucopyranose [German] [ACD/IUPAC Name]
1,3,4,6-Tétra-O-acétyl-2-désoxy-2-{[3-(1H-indol-3-yl)propanoyl]amino}-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Glucopyranose, 2-deoxy-2-[[3-(1H-indol-3-yl)-1-oxopropyl]amino]-, 1,3,4,6-tetraacetate [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: 711.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.0±3.0 kJ/mol
Flash Point: 384.2±32.9 °C
Index of Refraction: 1.575
Molar Refractivity: 127.7±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 35.47
ACD/KOC (pH 5.5): 447.74
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 35.47
ACD/KOC (pH 7.4): 447.74
Polar Surface Area: 159 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 58.0±5.0 dyne/cm
Molar Volume: 386.8±5.0 cm3

Click to predict properties on the Chemicalize site


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