ChemSpider 2D Image | 5'-Deoxy-2-ethynyl-5'-fluoroadenosine | C12H12FN5O3

5'-Deoxy-2-ethynyl-5'-fluoroadenosine

  • Molecular FormulaC12H12FN5O3
  • Average mass293.254 Da
  • Monoisotopic mass293.092407 Da
  • ChemSpider ID35035871

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-Deoxy-2-ethynyl-5'-fluoroadenosine [ACD/IUPAC Name]
5'-Desoxy-2-ethinyl-5'-fluoradenosin [German] [ACD/IUPAC Name]
5'-Désoxy-2-éthynyl-5'-fluoroadénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-deoxy-2-ethynyl-5'-fluoro- [ACD/Index Name]
EFA

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

Density: 1.8±0.1 g/cm3
Boiling Point: 691.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 372.2±34.3 °C
Index of Refraction: 1.761
Molar Refractivity: 68.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.59
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.70
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.71
Polar Surface Area: 119 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 69.7±7.0 dyne/cm
Molar Volume: 165.1±7.0 cm3

Click to predict properties on the Chemicalize site


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