ChemSpider 2D Image | 9-(2-Deoxy-beta-D-threo-pentofuranosyl)-6-(2-hydroxypropoxy)-9H-purin-2-amine | C13H19N5O5

9-(2-Deoxy-β-D-threo-pentofuranosyl)-6-(2-hydroxypropoxy)-9H-purin-2-amine

  • Molecular FormulaC13H19N5O5
  • Average mass325.320 Da
  • Monoisotopic mass325.138611 Da
  • ChemSpider ID57530362

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

9-(2-Deoxy-β-D-threo-pentofuranosyl)-6-(2-hydroxypropoxy)-9H-purin-2-amine [ACD/IUPAC Name]
9-(2-Desoxy-β-D-threo-pentofuranosyl)-6-(2-hydroxypropoxy)-9H-purin-2-amin [German] [ACD/IUPAC Name]
9-(2-Désoxy-β-D-thréo-pentofuranosyl)-6-(2-hydroxypropoxy)-9H-purin-2-amine [French] [ACD/IUPAC Name]
9H-Purin-2-amine, 9-(2-deoxy-β-D-threo-pentofuranosyl)-6-(2-hydroxypropoxy)- [ACD/Index Name]
1327339-22-9 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 726.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 393.0±35.7 °C
Index of Refraction: 1.761
Molar Refractivity: 75.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.73
ACD/LogD (pH 5.5): -0.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.13
ACD/LogD (pH 7.4): -0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.16
Polar Surface Area: 149 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 77.6±7.0 dyne/cm
Molar Volume: 182.0±7.0 cm3

Click to predict properties on the Chemicalize site


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