ChemSpider 2D Image | 5'-Amino-8-bromo-5'-deoxyadenosine | C10H13BrN6O3

5'-Amino-8-bromo-5'-deoxyadenosine

  • Molecular FormulaC10H13BrN6O3
  • Average mass345.153 Da
  • Monoisotopic mass344.023254 Da
  • ChemSpider ID35035538
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

5'-Amino-8-brom-5'-desoxyadenosin [German] [ACD/IUPAC Name]
5'-Amino-8-bromo-5'-deoxyadenosine [ACD/IUPAC Name]
5'-Amino-8-bromo-5'-désoxyadénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-amino-8-bromo-5'-deoxy- [ACD/Index Name]
5NB

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.5±0.1 g/cm3
Boiling Point: 690.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 371.3±34.3 °C
Index of Refraction: 1.968
Molar Refractivity: 68.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -3.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 113.6±7.0 dyne/cm
Molar Volume: 140.2±7.0 cm3

Click to predict properties on the Chemicalize site






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