ChemSpider 2D Image | 9-(beta-L-Glucopyranosyl)-9H-purin-6-amine | C11H15N5O5

9-(β-L-Glucopyranosyl)-9H-purin-6-amine

  • Molecular FormulaC11H15N5O5
  • Average mass297.267 Da
  • Monoisotopic mass297.107330 Da
  • ChemSpider ID62569120

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

9-(β-L-Glucopyranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(β-L-Glucopyranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(β-L-Glucopyranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-β-L-glucopyranosyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 2.1±0.1 g/cm3
Boiling Point: 694.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 373.6±34.3 °C
Index of Refraction: 1.892
Molar Refractivity: 65.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 0.42
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.80
ACD/LogD (pH 7.4): -0.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.17
Polar Surface Area: 160 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 108.8±7.0 dyne/cm
Molar Volume: 141.5±7.0 cm3

Click to predict properties on the Chemicalize site


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