2'-Chloro-2'-Deoxyuridine

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Properties Simple | Detailed

Formula C9H11ClN2O5++
IUPAC Name 1-[(2r,3r,4r,5r)-3-chloro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 262.647 g·mol−1
Heat of Formation -885.1 ± 16.7 kJ·mol−1
Dipole Moment 6.22 ± 1.08 D
Volume 268.65 Å 3
Surface Area 239.99 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,3r,4r,5r)-3-chloro-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione
  • 1-[(2r,3r,4r,5r)-3-chloro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
  • 1-[(2r,3r,4r,5r)-3-chloro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 1-[(2r,3r,4r,5r)-3-chloro-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone
  • 2'-deoxy-2'-chlorouridine
  • uridine, 2'-chloro-2'-deoxy- (8ci)(9ci)
InChIKey XOTUXDQKWDTKSI-XVFCMESISA-N
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