ChemSpider 2D Image | 6-Iodo-3-[(2xi)-beta-D-threo-pentofuranosyl]-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-amine | C11H15IN4O4

6-Iodo-3-[(2ξ)-β-D-threo-pentofuranosyl]-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-amine

  • Molecular FormulaC11H15IN4O4
  • Average mass394.166 Da
  • Monoisotopic mass394.013794 Da
  • ChemSpider ID111308303

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

1H-Imidazo[4,5-b]pyridin-7-amine, 2,3-dihydro-6-iodo-3-[(2ξ)-β-D-threo-pentofuranosyl]- [ACD/Index Name]
6-Iod-3-[(2ξ)-β-D-threo-pentofuranosyl]-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-amin [German] [ACD/IUPAC Name]
6-Iodo-3-[(2ξ)-β-D-threo-pentofuranosyl]-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-amine [ACD/IUPAC Name]
6-Iodo-3-[(2ξ)-β-D-thréo-pentofuranosyl]-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-amine [French] [ACD/IUPAC Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 688.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.0±3.0 kJ/mol
Flash Point: 370.3±31.5 °C
Index of Refraction: 1.773
Molar Refractivity: 78.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 0.51
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.74
ACD/LogD (pH 7.4): 0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.92
Polar Surface Area: 124 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 100.2±3.0 dyne/cm
Molar Volume: 189.2±3.0 cm3

Click to predict properties on the Chemicalize site


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