ChemSpider 2D Image | 5'-{[2-(Aminooxy)ethyl](methyl)amino}-5'-deoxy-8-methyladenosine | C14H23N7O4

5'-{[2-(Aminooxy)ethyl](methyl)amino}-5'-deoxy-8-methyladenosine

  • Molecular FormulaC14H23N7O4
  • Average mass353.377 Da
  • Monoisotopic mass353.181152 Da
  • ChemSpider ID25044147

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-{[2-(Aminooxy)ethyl](methyl)amino}-5'-deoxy-8-methyladenosine [ACD/IUPAC Name]
5'-{[2-(Aminooxy)ethyl](methyl)amino}-5'-desoxy-8-methyladenosin [German] [ACD/IUPAC Name]
5'-{[2-(Aminooxy)éthyl](méthyl)amino}-5'-désoxy-8-méthyladénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-[[2-(aminooxy)ethyl]methylamino]-5'-deoxy-8-methyl- [ACD/Index Name]
AdoMet substrate analogue, 12a
M8M

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

Density: 1.7±0.1 g/cm3
Boiling Point: 698.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.4±3.0 kJ/mol
Flash Point: 376.4±31.5 °C
Index of Refraction: 1.749
Molar Refractivity: 84.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -0.06
ACD/LogD (pH 5.5): -3.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.12
Polar Surface Area: 158 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 73.2±7.0 dyne/cm
Molar Volume: 207.5±7.0 cm3

Click to predict properties on the Chemicalize site


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