ChemSpider 2D Image | 9-(2-DEOXY-BETA-D-RIBOFURANOSYL)-6-METHYLPURINE | C11H14N4O3

9-(2-DEOXY-β-D-RIBOFURANOSYL)-6-METHYLPURINE

  • Molecular FormulaC11H14N4O3
  • Average mass250.254 Da
  • Monoisotopic mass250.106583 Da
  • ChemSpider ID26330099

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

9-(2-Deoxy-α-L-erythro-pentofuranosyl)-6-methyl-9H-purine [ACD/IUPAC Name]
9-(2-DEOXY-β-D-RIBOFURANOSYL)-6-METHYLPURINE
9-(2-Desoxy-α-L-erythro-pentofuranosyl)-6-methyl-9H-purin [German] [ACD/IUPAC Name]
9-(2-Désoxy-α-L-érythro-pentofuranosyl)-6-méthyl-9H-purine [French] [ACD/IUPAC Name]
9H-Purine, 9-(2-deoxy-α-L-erythro-pentofuranosyl)-6-methyl- [ACD/Index Name]
(2S,3R,5R)-2-(hydroxymethyl)-5-(6-methyl-9H-purin-9-yl)oxolan-3-ol
(2S,3R,5R)-2-(hydroxymethyl)-5-(6-methylpurin-9-yl)oxolan-3-ol

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

Density: 1.7±0.1 g/cm3
Boiling Point: 544.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 283.2±32.9 °C
Index of Refraction: 1.763
Molar Refractivity: 61.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.82
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.98
Polar Surface Area: 93 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 69.5±7.0 dyne/cm
Molar Volume: 149.3±7.0 cm3

Click to predict properties on the Chemicalize site


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