ChemSpider 2D Image | 1-{2-O-[2-(1H-Imidazol-1-yl)ethyl]-5-O-phosphono-beta-L-ribofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione | C15H21N4O9P

1-{2-O-[2-(1H-Imidazol-1-yl)ethyl]-5-O-phosphono-β-L-ribofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC15H21N4O9P
  • Average mass432.322 Da
  • Monoisotopic mass432.104614 Da
  • ChemSpider ID71360816

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-{2-O-[2-(1H-Imidazol-1-yl)ethyl]-5-O-phosphono-β-L-ribofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-{2-O-[2-(1H-Imidazol-1-yl)ethyl]-5-O-phosphono-β-L-ribofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-{2-O-[2-(1H-Imidazol-1-yl)éthyl]-5-O-phosphono-β-L-ribofuranosyl}-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[2-O-[2-(1H-imidazol-1-yl)ethyl]-5-O-phosphono-β-L-ribofuranosyl]-5-methyl- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.704
Molar Refractivity: 94.0±0.5 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -1.21
ACD/LogD (pH 5.5): -5.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 182 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 84.0±7.0 dyne/cm
Molar Volume: 242.1±7.0 cm3

Click to predict properties on the Chemicalize site


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