ChemSpider 2D Image | 9-(5-{[(2Z)-4-Amino-2-buten-1-yl](methyl)amino}-5-deoxy-alpha-L-arabinofuranosyl)-9H-purin-6-amine | C15H23N7O3

9-(5-{[(2Z)-4-Amino-2-buten-1-yl](methyl)amino}-5-deoxy-α-L-arabinofuranosyl)-9H-purin-6-amine

  • Molecular FormulaC15H23N7O3
  • Average mass349.388 Da
  • Monoisotopic mass349.186249 Da
  • ChemSpider ID57642108

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

9-(5-{[(2Z)-4-Amino-2-buten-1-yl](methyl)amino}-5-deoxy-α-L-arabinofuranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(5-{[(2Z)-4-Amino-2-buten-1-yl](methyl)amino}-5-desoxy-α-L-arabinofuranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(5-{[(2Z)-4-Amino-2-butén-1-yl](méthyl)amino}-5-désoxy-α-L-arabinofuranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-[5-[[(2Z)-4-amino-2-buten-1-yl]methylamino]-5-deoxy-α-L-arabinofuranosyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 656.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 351.0±34.3 °C
Index of Refraction: 1.739
Molar Refractivity: 87.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.00
ACD/LogD (pH 5.5): -4.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 149 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 71.5±7.0 dyne/cm
Molar Volume: 218.0±7.0 cm3

Click to predict properties on the Chemicalize site


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