5-(2-Bromoethyl)-2'-Deoxyuridine

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Properties Simple | Detailed

Formula C11H15BrN2O5++
IUPAC Name 5-(2-bromoethyl)-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 335.151 g·mol−1
Heat of Formation -899.8 ± 16.7 kJ·mol−1
Dipole Moment 5.53 ± 1.08 D
Volume 324.1 Å 3
Surface Area 279.35 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 2.52 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(2-bromo-ethyl)-1-(4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1h-pyrimidine-2,4-dione
  • 5-(2-bromoethyl)-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione
  • 5-(2-bromoethyl)-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
  • 5-(2-bromoethyl)-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 5-(2-bromoethyl)-1-[(2r,4s,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone
InChIKey ARAPHVJYXVDNPN-DJLDLDEBSA-N
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Elements H C O Br N