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

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Properties Simple | Detailed

Formula C10H15N2O7P++
IUPAC Name [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 306.209 g·mol−1
Heat of Formation -1566.1 ± 16.7 kJ·mol−1
Dipole Moment 6.44 ± 1.08 D
Volume 319.79 Å 3
Surface Area 289.52 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • 107132-16-1 (disodium salt)
  • 2',3'-dideoxythymidine-5'-monophosphate
  • 2',3'-dideoxythymidine-5'-monophosphate disodium salt
  • 2dt
  • 3'-deoxy-5'-thymidylic acid
  • 3'-deoxythymidine-5'-monophosphate
  • 5'-thymidylic acid, 3'-deoxy-
  • [(2s,5r)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2s,5r)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
  • [(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • d4m
  • ddtmp
CAS Number(s)
  • 3715-64-8
InChIKey WVNRRNJFRREKAR-JGVFFNPUSA-N
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