ChemSpider 2D Image | 9-(2-Deoxy-alpha-D-threo-pentofuranosyl)-9H-purin-6-amine | C10H13N5O3

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

  • Molecular FormulaC10H13N5O3
  • Average mass251.242 Da
  • Monoisotopic mass251.101837 Da
  • ChemSpider ID24765642

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

9-(2-Deoxy-α-D-threo-pentofuranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(2-Desoxy-α-D-threo-pentofuranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(2-Désoxy-α-D-thréo-pentofuranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-(2-deoxy-α-D-threo-pentofuranosyl)- [ACD/Index Name]
(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
2'-Deoxy-a-adenosine
3413-66-9 [RN]
958-09-8 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 627.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 333.1±34.3 °C
Index of Refraction: 1.863
Molar Refractivity: 59.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.55
ACD/LogD (pH 5.5): -0.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.02
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.51
Polar Surface Area: 119 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 93.7±7.0 dyne/cm
Molar Volume: 130.9±7.0 cm3

Click to predict properties on the Chemicalize site


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