ChemSpider 2D Image | 9-[2,3-Dideoxy-3-fluoro-beta-D-(2-~2~H_1_)-threo-pentofuranosyl]-9H-purin-6-amine | C10H11DFN5O2

9-[2,3-Dideoxy-3-fluoro-β-D-(2-2H1)-threo-pentofuranosyl]-9H-purin-6-amine

  • Molecular FormulaC10H11DFN5O2
  • Average mass254.239 Da
  • Monoisotopic mass254.103775 Da
  • ChemSpider ID9109271

  • 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-[2,3-Dideoxy-3-fluoro-β-D-(2-2H1)-threo-pentofuranosyl]-9H-purin-6-amine [ACD/IUPAC Name]
9-[2,3-Didésoxy-3-fluoro-β-D-(2-2H1)-thréo-pentofuranosyl]-9H-purin-6-amine [French] [ACD/IUPAC Name]
9-[2,3-Didesoxy-3-fluor-β-D-(2-2H1)-threo-pentofuranosyl]-9H-purin-6-amin [German] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-(2,3-dideoxy-3-fluoro-β-D-threo-pentofuranosyl-2-d)- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 541.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 281.2±32.9 °C
Index of Refraction: 1.796
Molar Refractivity: 58.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.20
ACD/LogD (pH 5.5): -0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.94
ACD/LogD (pH 7.4): -0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.72
Polar Surface Area: 99 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 75.0±7.0 dyne/cm
Molar Volume: 136.5±7.0 cm3

Click to predict properties on the Chemicalize site


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