(2R)-2-[(1R)-1-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-2-Oxoethoxy]-3-Oxopropyl Trihydrogen Diphosphate

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Properties Simple | Detailed

Formula C9H12N2O12P2++
IUPAC Name [(2r)-2-[(1r)-1-(2,4-dioxopyrimidin-1-yl)-2-oxo-ethoxy]-3-oxo-propyl] phosphono hydrogen phosphate
Molecular Mass 402.145 g·mol−1
Heat of Formation -2618.0 ± 16.7 kJ·mol−1
Dipole Moment 4.53 ± 1.08 D
Volume 381.54 Å 3
Surface Area 308.2 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy -1.70 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r)-2-[(1r)-1-(2,4-diketopyrimidin-1-yl)-2-keto-ethoxy]-3-keto-propyl] phosphono hydrogen phosphate
  • [(2r)-2-[(1r)-1-(2,4-dioxo-1-pyrimidinyl)-2-oxoethoxy]-3-oxopropyl] phosphono hydrogen phosphate
  • [(2r)-2-[(1r)-1-(2,4-dioxopyrimidin-1-yl)-2-oxo-ethoxy]-3-oxo-propyl] phosphono hydrogen phosphate
  • [(2r)-2-[(1r)-1-(2,4-dioxopyrimidin-1-yl)-2-oxoethoxy]-3-oxopropyl] phosphono hydrogen phosphate
  • dial-udp
  • diphosphoric acid, mono(2-(1-(3,4-dihydro-2,4-dioxo-1(2h)-pyrimidinyl)-2-oxoethoxy)-3-oxopropyl) ester, (r-(r*,r*))-
  • udp dialdehyde
CAS Number(s)
  • 60262-90-0
InChIKey RGUZLDGEKZUCSS-POYBYMJQSA-N
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