1-(3-Azido-3-Deoxy-β-D-Arabinofuranosyl)-5-Methyl-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C10H13N5O5
IUPAC Name 1-[(2r,3s,4s,5s)-4-azido-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 283.241 g·mol−1
Heat of Formation -560.7 ± 16.7 kJ·mol−1
Dipole Moment 2.54 ± 1.08 D
Volume 308.23 Å 3
Surface Area 275.91 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,3s,4s,5s)-4-azido-3-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,3s,4s,5s)-4-azido-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,3s,4s,5s)-4-azido-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,3s,4s,5s)-4-azido-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,3s,4s,5s)-4-azido-3-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone
  • 2,4(1h,3h)-pyrimidinedione, 1-(3-azido-3-deoxy-.beta.-d-arabinofuranosyl)-5-methyl-3'-azido-2'-ara-thymine
  • 3'-azido-2'-ara-thymine
  • 3'-n3-arat
CAS Number(s)
  • 99614-77-4
InChIKey DVRKESVZZVYJRB-JAGXHNFQSA-N
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