ChemSpider 2D Image | 9-(2,3,5-Tri-O-acetyl-beta-L-arabinofuranosyl)-9H-purin-2-amine | C16H19N5O7

9-(2,3,5-Tri-O-acetyl-β-L-arabinofuranosyl)-9H-purin-2-amine

  • Molecular FormulaC16H19N5O7
  • Average mass393.351 Da
  • Monoisotopic mass393.128448 Da
  • ChemSpider ID62479961

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2H-Purin-2-imine, 1,9-dihydro-9-(2,3,5-tri-O-acetyl-β-L-arabinofuranosyl)- [ACD/Index Name]
9-(2,3,5-Tri-O-acetyl-β-L-arabinofuranosyl)-1,9-dihydro-2H-purin-2-imin [German] [ACD/IUPAC Name]
9-(2,3,5-Tri-O-acetyl-β-L-arabinofuranosyl)-1,9-dihydro-2H-purin-2-imine [ACD/IUPAC Name]
9-(2,3,5-Tri-O-acétyl-β-L-arabinofuranosyl)-1,9-dihydro-2H-purin-2-imine [French] [ACD/IUPAC Name]
9-(2,3,5-Tri-O-acetyl-β-L-arabinofuranosyl)-9H-purin-2-amin [German] [ACD/IUPAC Name]
9-(2,3,5-Tri-O-acetyl-β-L-arabinofuranosyl)-9H-purin-2-amine [ACD/IUPAC Name]
9-(2,3,5-Tri-O-acétyl-β-L-arabinofuranosyl)-9H-purin-2-amine [French] [ACD/IUPAC Name]
9H-Purin-2-amine, 9-(2,3,5-tri-O-acetyl-β-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: 512.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.6±32.9 °C
Index of Refraction: 1.680
Molar Refractivity: 91.2±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -0.79
ACD/LogD (pH 5.5): -0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.69
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.18
Polar Surface Area: 152 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 62.7±7.0 dyne/cm
Molar Volume: 241.4±7.0 cm3

Click to predict properties on the Chemicalize site


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