ChemSpider 2D Image | 5-Methyl-1-[(2R,5S)-5-({[(2R)-2-oxido-4H-1,3,2-benzodioxaphosphinin-2-yl]oxy}methyl)-2,5-dihydro-2-furanyl]-2,4(1H,3H)-pyrimidinedione | C17H17N2O7P

5-Methyl-1-[(2R,5S)-5-({[(2R)-2-oxido-4H-1,3,2-benzodioxaphosphinin-2-yl]oxy}methyl)-2,5-dihydro-2-furanyl]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC17H17N2O7P
  • Average mass392.300 Da
  • Monoisotopic mass392.077332 Da
  • ChemSpider ID28640535

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2,4(1H,3H)-Pyrimidinedione, 1-[(2R,5S)-2,5-dihydro-5-[[[(2R)-2-oxido-4H-1,3,2-benzodioxaphosphorin-2-yl]oxy]methyl]-2-furanyl]-5-methyl- [ACD/Index Name]
5-Methyl-1-[(2R,5S)-5-({[(2R)-2-oxido-4H-1,3,2-benzodioxaphosphinin-2-yl]oxy}methyl)-2,5-dihydro-2-furanyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-Methyl-1-[(2R,5S)-5-({[(2R)-2-oxido-4H-1,3,2-benzodioxaphosphinin-2-yl]oxy}methyl)-2,5-dihydro-2-furanyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-Méthyl-1-[(2R,5S)-5-({[(2R)-2-oxydo-4H-1,3,2-benzodioxaphosphinin-2-yl]oxy}méthyl)-2,5-dihydro-2-furanyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.633
Molar Refractivity: 92.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.28
ACD/LogD (pH 5.5): 0.35
ACD/BCF (pH 5.5): 1.08
ACD/KOC (pH 5.5): 36.81
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.07
ACD/KOC (pH 7.4): 36.50
Polar Surface Area: 113 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 66.1±5.0 dyne/cm
Molar Volume: 259.3±5.0 cm3

Click to predict properties on the Chemicalize site


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