ChemSpider 2D Image | (Hydroxy{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]oxy}phosphoryl)amidodiphosphoric acid | C9H16N3O13P3

(Hydroxy{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]oxy}phosphoryl)amidodiphosphoric acid

  • Molecular FormulaC9H16N3O13P3
  • Average mass467.157 Da
  • Monoisotopic mass466.989594 Da
  • ChemSpider ID25031459

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(Hydroxy{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]oxy}phosphoryl)amidodiphosphoric acid [ACD/IUPAC Name]
(Hydroxy{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]oxy}phosphoryl)amidodiphosphorsäure [German] [ACD/IUPAC Name]
Acide (hydroxy{[(2R,3S,5R)-3-hydroxy-5-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tétrahydro-2-furanyl]oxy}phosphoryl)amidodiphosphorique [French] [ACD/IUPAC Name]
Amidodiphosphoric acid, P-[[[(2R,3S,5R)-5-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)tetrahydro-3-hydroxy-2-furanyl]oxy]hydroxyphosphinyl]- [ACD/Index Name]

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: 1.636
Molar Refractivity: 83.8±0.4 cm3
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -5.95
ACD/LogD (pH 5.5): -12.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 271 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 113.6±5.0 dyne/cm
Molar Volume: 233.6±5.0 cm3

Click to predict properties on the Chemicalize site


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