[(2S,5R)-5-(5-Methyl-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-2,5-Dihydro-2-Furanyl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C10H13N2O7P++
IUPAC Name [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 304.193 g·mol−1
Heat of Formation -1459.3 ± 16.7 kJ·mol−1
Dipole Moment 6.67 ± 1.08 D
Volume 314.5 Å 3
Surface Area 274.65 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
Synonyms
  • 2',3'-didehydro-,3'-deoxy-thymidine 5'-monophosphate
  • 2',3'-dideoxy-2',3-didehydrothymidine 5'-monophosphate, 2',3'-dehydro-2',3'-deoxy-thymidine 5'-monophosphate
  • 3',5'-cyclic dtmp
  • [(2s,5r)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2s,5r)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2s,5r)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate
  • [(5r)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate
  • ctmp
  • cyclic 3',5'-thymidine monophosphate
  • cyclic tmp
  • d4t-mp
  • d4tmp
  • thymidine, cyclic 3',5'-(hydrogen phosphate)
CAS Number(s)
  • 6453-60-7
  • 6618-82-2
InChIKey XLPGURCDSRIXFL-JGVFFNPUSA-N
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