ChemSpider 2D Image | 1-[(5S)-5-C-Phosphono-D-ribofuranosyl]-2,4,6(1H,3H,5H)-pyrimidinetrione | C9H13N2O10P

1-[(5S)-5-C-Phosphono-D-ribofuranosyl]-2,4,6(1H,3H,5H)-pyrimidinetrione

  • Molecular FormulaC9H13N2O10P
  • Average mass340.181 Da
  • Monoisotopic mass340.030792 Da
  • ChemSpider ID57491850

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

1-[(5S)-5-C-Phosphono-D-ribofuranosyl]-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
1-[(5S)-5-C-Phosphono-D-ribofuranosyl]-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
1-[(5S)-5-C-Phosphono-D-ribofuranosyl]-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]
2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-[(5S)-5-C-phosphono-D-ribofuranosyl]- [ACD/Index Name]
29741-00-2 [RN]

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: 1.684
Molar Refractivity: 63.1±0.3 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -2.81
ACD/LogD (pH 5.5): -7.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 204 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 136.5±3.0 dyne/cm
Molar Volume: 166.2±3.0 cm3

Click to predict properties on the Chemicalize site


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