5-(2-Chloroethyl)-1-(2-Deoxy-α-D-Erythro-Pentofuranosyl)-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C11H15ClN2O5
IUPAC Name 5-(2-chloroethyl)-1-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 290.700 g·mol−1
Heat of Formation -963.0 ± 16.7 kJ·mol−1
Dipole Moment 6.67 ± 1.08 D
Volume 318.61 Å 3
Surface Area 282.49 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(2-chloro-ethyl)-1-(4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1h-pyrimidine-2,4-dione
  • 5-(2-chloroethyl)-1-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione
  • 5-(2-chloroethyl)-1-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 5-(2-chloroethyl)-1-[(2s,4s,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone
  • 5-(2-chloroethyl)-2'-deoxyuridine
  • cedu
  • uridine, 5-(2-chloroethyl)-2'-deoxy-
CAS Number(s)
  • 90301-59-0
InChIKey UUSHUCRHZYSZKI-YIZRAAEISA-N
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