ChemSpider 2D Image | 1-deaza-adenosine | C11H14N4O4

1-deaza-adenosine

  • Molecular FormulaC11H14N4O4
  • Average mass266.253 Da
  • Monoisotopic mass266.101501 Da
  • ChemSpider ID26330236

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-deaza-adenosine
3-(α-L-Arabinofuranosyl)-3H-imidazo[4,5-b]pyridin-7-amin [German] [ACD/IUPAC Name]
3-(α-L-Arabinofuranosyl)-3H-imidazo[4,5-b]pyridin-7-amine [ACD/IUPAC Name]
3-(α-L-Arabinofuranosyl)-3H-imidazo[4,5-b]pyridin-7-amine [French] [ACD/IUPAC Name]
3H-Imidazo[4,5-b]pyridin-7-amine, 3-α-L-arabinofuranosyl- [ACD/Index Name]
(2R,3R,4R,5S)-2-{7-amino-3H-imidazo[4,5-b]pyridin-3-yl}-5-(hydroxymethyl)oxolane-3,4-diol

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

Density: 1.9±0.1 g/cm3
Boiling Point: 674.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 361.8±34.3 °C
Index of Refraction: 1.834
Molar Refractivity: 61.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.18
ACD/LogD (pH 5.5): -2.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.13
Polar Surface Area: 127 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 91.6±7.0 dyne/cm
Molar Volume: 139.5±7.0 cm3

Click to predict properties on the Chemicalize site


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