5-[(E)-2-Bromovinyl]-1-(α-D-Ribofuranosyl)-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C11H13BrN2O6++
IUPAC Name 5-[(e)-2-bromovinyl]-1-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 349.135 g·mol−1
Heat of Formation -963.5 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 326.26 Å 3
Surface Area 287.17 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(2-bromovinyl)uridine
  • 5-[(e)-2-bromoethenyl]-1-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
  • 5-[(e)-2-bromovinyl]-1-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione
  • 5-[(e)-2-bromovinyl]-1-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 5-[(e)-2-bromovinyl]-1-[(2s,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone
  • uridine, 5-(2-bromoethenyl)-, (e)-
CAS Number(s)
  • 86391-68-6
InChIKey GCQYYIHYQMVWLT-DYCRGCIJSA-N
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Elements H C O Br N