ChemSpider 2D Image | 2-Amino-9-(beta-D-glucopyranosyl)-1,9-dihydro-6H-purin-6-one | C11H15N5O6

2-Amino-9-(β-D-glucopyranosyl)-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC11H15N5O6
  • Average mass313.267 Da
  • Monoisotopic mass313.102234 Da
  • ChemSpider ID26600546

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-Amino-9-(β-D-glucopyranosyl)-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-(β-D-glucopyranosyl)-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-(β-D-glucopyranosyl)-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-amino-9-β-D-glucopyranosyl-1,9-dihydro- [ACD/Index Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.934
Molar Refractivity: 66.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 0.22
ACD/LogD (pH 5.5): -1.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.23
ACD/LogD (pH 7.4): -1.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.20
Polar Surface Area: 175 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 123.5±7.0 dyne/cm
Molar Volume: 138.8±7.0 cm3

Click to predict properties on the Chemicalize site


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