5'-Deoxy-5'-Fluorothymidine

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Properties Simple | Detailed

Formula C10H13FN2O4
IUPAC Name 1-[(2r,4s,5s)-5-(fluoromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 244.220 g·mol−1
Heat of Formation -908.8 ± 16.7 kJ·mol−1
Dipole Moment 3.56 ± 1.08 D
Volume 267.66 Å 3
Surface Area 240.34 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,4s,5s)-5-(fluoromethyl)-4-hydroxy-2-tetrahydrofuranyl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,4s,5s)-5-(fluoromethyl)-4-hydroxy-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4s,5s)-5-(fluoromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4s,5s)-5-(fluoromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone
  • 1-[(2r,4s,5s)-5-(fluoromethyl)-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
  • 5'-deoxy-5'fluorothymidine
  • thymidine, 5'-deoxy-5'-fluoro- (8ci)(9ci)
InChIKey MYWVPKQWFIVGJZ-XLPZGREQSA-N
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