3',5'-Di-O-Acetyl-5-[(E)-2-Bromovinyl]-2'-Deoxyuridine

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Properties Simple | Detailed

Formula C15H17BrN2O7++
IUPAC Name [(2r,3s,5r)-3-acetoxy-5-[5-[(e)-2-bromovinyl]-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate
Molecular Mass 417.209 g·mol−1
Heat of Formation -1198.2 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 411.18 Å 3
Surface Area 348.14 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -0.88 ± eV
Point Group Symmetry C1
Synonyms
  • 3',5'-di-o-acetyl-5-(2-bromovinyl)-2'-deoxyuridine
  • [(2r,3s,5r)-2-(acetoxymethyl)-5-[5-[(e)-2-bromovinyl]-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-3-yl] acetate
  • [(2r,3s,5r)-2-(acetyloxymethyl)-5-[5-[(e)-2-bromoethenyl]-2,4-dioxo-pyrimidin-1-yl]oxolan-3-yl] ethanoate
  • [(2r,3s,5r)-2-(acetyloxymethyl)-5-[5-[(e)-2-bromoethenyl]-2,4-dioxopyrimidin-1-yl]oxolan-3-yl] acetate
  • acetic acid [(2r,3s,5r)-2-(acetoxymethyl)-5-[5-[(e)-2-bromovinyl]-2,4-diketo-pyrimidin-1-yl]tetrahydrofuran-3-yl] ester
  • acetic acid [(2r,3s,5r)-2-(acetoxymethyl)-5-[5-[(e)-2-bromovinyl]-2,4-dioxo-1-pyrimidinyl]-3-tetrahydrofuranyl] ester
  • acetic acid, 3-acetoxy-5-[5-(2-bromo-vinyl)-2,4-dioxo-3,4-dihydro-2h-pyrimidin-1-yl]-tetrahydro-furan-2-ylmethyl ester
  • bvdu-dia
CAS Number(s)
  • 91593-18-9
InChIKey XOXDXFVBRHEPDN-PZQWPYDESA-N
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