ChemSpider 2D Image | 5-Methyl-1-[2,3-O-(2-phosphonoethylidene)-beta-L-xylofuranosyl]-2,4(1H,3H)-pyrimidinedione | C12H17N2O9P

5-Methyl-1-[2,3-O-(2-phosphonoethylidene)-β-L-xylofuranosyl]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC12H17N2O9P
  • Average mass364.245 Da
  • Monoisotopic mass364.067169 Da
  • ChemSpider ID57492271

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

2,4(1H,3H)-Pyrimidinedione, 5-methyl-1-[2,3-O-(2-phosphonoethylidene)-β-L-xylofuranosyl]- [ACD/Index Name]
5-Methyl-1-[2,3-O-(2-phosphonoethyliden)-β-L-xylofuranosyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-Methyl-1-[2,3-O-(2-phosphonoethylidene)-β-L-xylofuranosyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-Méthyl-1-[2,3-O-(2-phosphonoéthylidène)-β-L-xylofuranosyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
922508-03-0 [RN]

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: 1.575
Molar Refractivity: 74.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -2.11
ACD/LogD (pH 5.5): -5.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 165 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 226.3±3.0 cm3

Click to predict properties on the Chemicalize site


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