1-(2-Deoxy-β-D-Threo-Pentofuranosyl)-5-Methyl-2,4(1H,3H)-Pyrimidinedione

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Formula C10H14N2O5++
IUPAC Name 1-[(2r,4r,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 242.229 g·mol−1
Heat of Formation -905.2 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 269.45 Å 3
Surface Area 242.47 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2'-deoxy-beta-d-threo-pentofuranosyl)thymine
  • 1-(2'-deoxy-beta-threopentofuranosyl)thymine
  • 1-[(2r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,4r,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4r,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,4r,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4r,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone
  • 1-dpft
  • 2,4(1h,3h)-pyrimidinedione, 1-(2-deoxy-.beta.-d-threo-pentofuranosyl)-5-methyl-
  • 2,4(1h,3h)-pyrimidinedione, 1-(2-deoxy-beta-d-threo-pentofuranosyl)-5-methyl-
  • bio1_000453
  • bio1_000942
  • bio1_001431
  • t- b-d-threo
  • thymidine b-d-threo
CAS Number(s)
  • 16053-52-4
InChIKey IQFYYKKMVGJFEH-BWZBUEFSSA-N
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