ChemSpider 2D Image | 9-(2-Deoxy-beta-D-threo-pentofuranosyl)-1-methyl(8-~3~H)-1,9-dihydro-6H-purin-6-imine | C11H14TN5O3

9-(2-Deoxy-β-D-threo-pentofuranosyl)-1-methyl(8-3H)-1,9-dihydro-6H-purin-6-imine

  • Molecular FormulaC11H14TN5O3
  • Average mass267.277 Da
  • Monoisotopic mass267.125702 Da
  • ChemSpider ID114394370

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

6H-Purin-8-t-6-imine, 9-(2-deoxy-β-D-threo-pentofuranosyl)-1,9-dihydro-1-methyl- [ACD/Index Name]
9-(2-Deoxy-β-D-threo-pentofuranosyl)-1-methyl(8-3H)-1,9-dihydro-6H-purin-6-imine [ACD/IUPAC Name]
9-(2-Desoxy-β-D-threo-pentofuranosyl)-1-methyl(8-3H)-1,9-dihydro-6H-purin-6-imin [German] [ACD/IUPAC Name]
9-(2-Désoxy-β-D-thréo-pentofuranosyl)-1-méthyl(8-3H)-1,9-dihydro-6H-purin-6-imine [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 609.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.2±3.0 kJ/mol
Flash Point: 322.5±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -2.91
ACD/LogD (pH 5.5): -2.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.61
Polar Surface Area: 107 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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