ChemSpider 2D Image | [[(2R,3S,5S)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-5-iodo-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate | C9H14IN2O14P3

[[(2R,3S,5S)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-5-iodo-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate

  • Molecular FormulaC9H14IN2O14P3
  • Average mass594.038 Da
  • Monoisotopic mass593.870239 Da
  • ChemSpider ID67038538
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






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

iododeoxyuridine-5'-triphosphate

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

Density: 2.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.679
Molar Refractivity: 95.1±0.4 cm3
#H bond acceptors: 16
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -4.30
ACD/LogD (pH 5.5): -10.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 268 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 119.4±5.0 dyne/cm
Molar Volume: 251.8±5.0 cm3

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