ChemSpider 2D Image | 1-(2-Deoxy-beta-L-threo-pentofuranosyl)(2,7,8-~2~H_3_)-1H-imidazo[2,1-b]purin-4(5H)-one | C12H10D3N5O4

1-(2-Deoxy-β-L-threo-pentofuranosyl)(2,7,8-2H3)-1H-imidazo[2,1-b]purin-4(5H)-one

  • Molecular FormulaC12H10D3N5O4
  • Average mass294.281 Da
  • Monoisotopic mass294.115570 Da
  • ChemSpider ID78076026

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1-(2-Deoxy-β-L-threo-pentofuranosyl)(2,7,8-2H3)-1H-imidazo[2,1-b]purin-4(5H)-one [ACD/IUPAC Name]
1-(2-Desoxy-β-L-threo-pentofuranosyl)(2,7,8-2H3)-1H-imidazo[2,1-b]purin-4(5H)-on [German] [ACD/IUPAC Name]
1-(2-Désoxy-β-L-thréo-pentofuranosyl)(2,7,8-2H3)-1H-imidazo[2,1-b]purin-4(5H)-one [French] [ACD/IUPAC Name]
1H-Imidazo[2,1-b]purin-4(5H)-one-2,7,8-d3, 1-(2-deoxy-β-L-threo-pentofuranosyl)- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.916
Molar Refractivity: 68.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.30
ACD/LogD (pH 5.5): -1.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.92
ACD/LogD (pH 7.4): -1.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.96
Polar Surface Area: 114 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 100.9±7.0 dyne/cm
Molar Volume: 145.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement