5'-O-Aminothymidine

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Properties Simple | Detailed

Formula C10H15N3O5
IUPAC Name 1-[(2r,4s,5r)-5-(aminooxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 257.243 g·mol−1
Heat of Formation -762.4 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 286.56 Å 3
Surface Area 256.22 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 2.71 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,4s,5r)-5-(aminooxymethyl)-4-hydroxy-2-tetrahydrofuranyl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-5-(aminooxymethyl)-4-hydroxy-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-5-(aminooxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-5-(aminooxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone
  • 1-[(2r,4s,5r)-5-(aminooxymethyl)-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
  • 5'-aminothymidine
  • 5-(aminomethyl)-2'-deoxyuridine
CAS Number(s)
  • 70465-55-3
InChIKey CHNUETKYLYMAAU-XLPZGREQSA-N
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