ChemSpider 2D Image | 1-(5-Deoxy-alpha-D-glycero-pentofuranosyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione | C9H11FN2O5

1-(5-Deoxy-α-D-glycero-pentofuranosyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC9H11FN2O5
  • Average mass246.192 Da
  • Monoisotopic mass246.065201 Da
  • ChemSpider ID114391658

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

1-(5-Deoxy-α-D-glycero-pentofuranosyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-(5-Desoxy-α-D-glycero-pentofuranosyl)-5-fluor-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-(5-Désoxy-α-D-glycéro-pentofuranosyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-(5-deoxy-α-D-glycero-pentofuranosyl)-5-fluoro- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 51.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.96
ACD/LogD (pH 5.5): -1.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.01
ACD/LogD (pH 7.4): -1.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.50
Polar Surface Area: 99 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 69.9±5.0 dyne/cm
Molar Volume: 150.7±5.0 cm3

Click to predict properties on the Chemicalize site


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