3'-Acetamido-3'-Deoxythymidine

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Properties Simple | Detailed

Formula C12H17N3O5
IUPAC Name n-[(2s,3s,5r)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]acetamide
Molecular Mass 283.280 g·mol−1
Heat of Formation -915.8 ± 16.7 kJ·mol−1
Dipole Moment 5.68 ± 1.08 D
Volume 326.13 Å 3
Surface Area 293.74 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.31 ± eV
Point Group Symmetry C1
Synonyms
  • ((((3'-deoxy-3'-thymidinyl)-amino)carbonyl)methyl)
  • 3'-acetylamino-3'-deoxythymidine
  • 3'-acetylamino-3'-dt
  • 3'-deoxy-3'-acetamido-thymidine
  • adt
  • n-[(2s,3s,5r)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-tetrahydrofuranyl]acetamide
  • n-[(2s,3s,5r)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-3-yl]ethanamide
  • n-[(2s,3s,5r)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]acetamide
  • n-[(2s,3s,5r)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]acetamide
  • n-[(2s,3s,5r)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-2-methylol-tetrahydrofuran-3-yl]acetamide
  • thymidine, 3'-(acetylamino)-3'-deoxy-
CAS Number(s)
  • 70465-85-9
InChIKey OCWNRLPPKHGFCE-IVZWLZJFSA-N
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