ChemSpider 2D Image | {[{[(2S,3R,4S,5S)-5-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]oxy}(methoxy)phosphoryl]methyl}phosphonic acid | C10H16N2O11P2

{[{[(2S,3R,4S,5S)-5-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]oxy}(methoxy)phosphoryl]methyl}phosphonic acid

  • Molecular FormulaC10H16N2O11P2
  • Average mass402.188 Da
  • Monoisotopic mass402.022919 Da
  • ChemSpider ID68025334

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

{[{[(2S,3R,4S,5S)-5-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]oxy}(methoxy)phosphoryl]methyl}phosphonic acid [ACD/IUPAC Name]
{[{[(2S,3R,4S,5S)-5-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]oxy}(methoxy)phosphoryl]methyl}phosphonsäure [German] [ACD/IUPAC Name]
Acide {[{[(2S,3R,4S,5S)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytétrahydro-2-furanyl]oxy}(méthoxy)phosphoryl]méthyl}phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [[[[(2S,3R,4S,5S)-5-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)tetrahydro-3,4-dihydroxy-2-furanyl]oxy]methoxyphosphinyl]methyl]- [ACD/Index Name]
MRS2782

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: 1.613
Molar Refractivity: 76.7±0.4 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -4.03
ACD/LogD (pH 5.5): -7.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 212 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 95.0±5.0 dyne/cm
Molar Volume: 220.2±5.0 cm3

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