2'-Deoxy-5-[(1E)-3,3,3-Trifluoro-1-Propen-1-Yl]Uridine

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Properties Simple | Detailed

Formula C12H13F3N2O5
IUPAC Name 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-[(e)-3,3,3-trifluoroprop-1-enyl]pyrimidine-2,4-dione
Molecular Mass 322.237 g·mol−1
Heat of Formation -1497.1 ± 16.7 kJ·mol−1
Dipole Moment 7.99 ± 1.08 D
Volume 330.92 Å 3
Surface Area 290.75 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 1.91 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-2'-deoxy-5-(3,3,3-trifluoro-1-propenyl)uridine
  • (e)-5-(3,3,3-trifluoro-1-propenyl)-2'-deoxyuridine
  • (e)-5-(3,3,3-trifluoro-1-propenyl)deoxyuridine
  • 1-(4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-(3,3,3-trifluoro-propenyl)-1h-pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-[(e)-3,3,3-trifluoroprop-1-enyl]pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-[(e)-3,3,3-trifluoroprop-1-enyl]pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-[(e)-3,3,3-trifluoroprop-1-enyl]pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-[(e)-3,3,3-trifluoroprop-1-enyl]pyrimidine-2,4-quinone
  • 5-(3,3,3-trifluoro-1-propenyl) 2'-deoxyuridine
  • uridine, 2'-deoxy-5-(3,3,3-trifluoro-1-propenyl)-, (e)-
CAS Number(s)
  • 69819-96-1
InChIKey RNAYUXCOGSHVCL-PIXDULNESA-N
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