ChemSpider 2D Image | 9-{2-[(2-~2~H_1_)Deoxy]-beta-D-arabinofuranosyl}-9H-purine-2,6-diamine | C10H13DN6O3

9-{2-[(2-2H1)Deoxy]-β-D-arabinofuranosyl}-9H-purine-2,6-diamine

  • Molecular FormulaC10H13DN6O3
  • Average mass267.263 Da
  • Monoisotopic mass267.119019 Da
  • ChemSpider ID9840904

  • 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

9-{2-[(2-2H1)Deoxy]-β-D-arabinofuranosyl}-9H-purine-2,6-diamine [ACD/IUPAC Name]
9-{2-[(2-2H1)Desoxy]-β-D-arabinofuranosyl}-9H-purin-2,6-diamin [German] [ACD/IUPAC Name]
9-{2-[(2-2H1)Désoxy]-β-D-arabinofuranosyl}-9H-purine-2,6-diamine [French] [ACD/IUPAC Name]
9H-Purine-2,6-diamine, 9-[2-(deoxy-2-d)-β-D-arabinofuranosyl]- [ACD/Index Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 748.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.5±3.0 kJ/mol
Flash Point: 406.4±35.7 °C
Index of Refraction: 1.936
Molar Refractivity: 61.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.60
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.77
ACD/LogD (pH 7.4): -0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.69
Polar Surface Area: 145 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 110.9±7.0 dyne/cm
Molar Volume: 127.7±7.0 cm3

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