ChemSpider 2D Image | (2E)-2-{[(E)-1-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-hydroxyvinyl]oxy}-3-hydroxy-2-propen-1-yl dihydrogen phosphate | C9H11N2O9P

(2E)-2-{[(E)-1-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-hydroxyvinyl]oxy}-3-hydroxy-2-propen-1-yl dihydrogen phosphate

  • Molecular FormulaC9H11N2O9P
  • Average mass322.165 Da
  • Monoisotopic mass322.020203 Da
  • ChemSpider ID95714949
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-2-{[(E)-1-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-hydroxyvinyl]oxy}-3-hydroxy-2-propen-1-yl dihydrogen phosphate [ACD/IUPAC Name]
(2E)-2-{[(E)-1-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-hydroxyvinyl]oxy}-3-hydroxy-2-propen-1-yldihydrogenphosphat [German] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(E)-2-hydroxy-1-[[(E)-2-hydroxy-1-[(phosphonooxy)methyl]ethenyl]oxy]ethenyl]- [ACD/Index Name]
Dihydrogénophosphate de (2E)-2-{[(E)-1-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-hydroxyvinyl]oxy}-3-hydroxy-2-propén-1-yle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.650
Molar Refractivity: 64.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.06
ACD/LogD (pH 5.5): -6.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 100.6±3.0 dyne/cm
Molar Volume: 177.2±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement