ChemSpider 2D Image | PSB0474 | C17H20N2O13P2

PSB0474

  • Molecular FormulaC17H20N2O13P2
  • Average mass522.294 Da
  • Monoisotopic mass522.044067 Da
  • ChemSpider ID10166478

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3-(2-Oxo-2-phenylethyl)uridin5'-(trihydrogendiphosphat) [German] [ACD/IUPAC Name]
3-(2-Oxo-2-phenylethyl)uridine 5'-(trihydrogen diphosphate) [ACD/IUPAC Name]
3-(2-Oxo-2-phényléthyl)uridine-5'-(trihydrogène diphosphate) [French] [ACD/IUPAC Name]
3-phenacyl-UDP
PSB0474
Uridine, 3-(2-oxo-2-phenylethyl)-, 5'-(trihydrogen diphosphate) [ACD/Index Name]
[(2R,3S,4R,5R)-5-(2,4-dioxo-3-phenacylpyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
[(2R,3S,4R,5R)-5-[2,4-dioxo-3-(2-oxo-2-phenylethyl)pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
3-(2-oxo-2-phenylethyl)uridine-5'-diphosphate
3-phenacyl-1-β-D-ribofuranosylpyrimidine-2,4-dione 5'-diphosphate
More...

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

Density: 1.8±0.1 g/cm3
Boiling Point: 825.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.7±3.0 kJ/mol
Flash Point: 452.9±37.1 °C
Index of Refraction: 1.653
Molar Refractivity: 107.6±0.3 cm3
#H bond acceptors: 15
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -1.48
ACD/LogD (pH 5.5): -7.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 240 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 96.9±3.0 dyne/cm
Molar Volume: 293.8±3.0 cm3

Click to predict properties on the Chemicalize site


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