ChemSpider 2D Image | 9-(alpha-D-Arabinofuranosyl)-N~8~-butyl-9H-purine-6,8-diamine | C14H22N6O4

9-(α-D-Arabinofuranosyl)-N8-butyl-9H-purine-6,8-diamine

  • Molecular FormulaC14H22N6O4
  • Average mass338.362 Da
  • Monoisotopic mass338.170258 Da
  • ChemSpider ID62658097

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(8Z)-9-(α-D-Arabinofuranosyl)-8-(butylimino)-8,9-dihydro-7H-purin-6-amin [German] [ACD/IUPAC Name]
(8Z)-9-(α-D-Arabinofuranosyl)-8-(butylimino)-8,9-dihydro-7H-purin-6-amine [ACD/IUPAC Name]
(8Z)-9-(α-D-Arabinofuranosyl)-8-(butylimino)-8,9-dihydro-7H-purin-6-amine [French] [ACD/IUPAC Name]
7H-Purin-6-amine, 9-α-D-arabinofuranosyl-8-(butylimino)-8,9-dihydro-, (8Z)- [ACD/Index Name]
9-(α-D-Arabinofuranosyl)-N8-butyl-9H-purin-6,8-diamin [German] [ACD/IUPAC Name]
9-(α-D-Arabinofuranosyl)-N8-butyl-9H-purine-6,8-diamine [ACD/IUPAC Name]
9-(α-D-Arabinofuranosyl)-N8-butyl-9H-purine-6,8-diamine [French] [ACD/IUPAC Name]
9H-Purine-6,8-diamine, 9-α-D-arabinofuranosyl-N8-butyl- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 626.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 332.4±34.3 °C
Index of Refraction: 1.766
Molar Refractivity: 81.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 0.15
ACD/LogD (pH 5.5): -0.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.53
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.66
Polar Surface Area: 149 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 75.9±7.0 dyne/cm
Molar Volume: 196.3±7.0 cm3

Click to predict properties on the Chemicalize site


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