1-(3-Azido-2,3-Dideoxy-β-D-Threo-Pentofuranosyl)-5-Methyl-2,4(1H,3H)-Pyrimidinedione

Molecule SVG Image

Properties Simple | Detailed

Formula C10H13N5O4
IUPAC Name 1-[(2r,4r,5s)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 267.241 g·mol−1
Heat of Formation -399.6 ± 16.7 kJ·mol−1
Dipole Moment 4.46 ± 1.08 D
Volume 296.78 Å 3
Surface Area 249.74 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy 2.48 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3'-azido-2',3'-dideoxy-.beta.-d-threo-pentofuranosyl)thymine
  • 1-(3'-azido-2',3'-dideoxy-beta-d-threo-pentofuranosyl)thymine
  • 1-[(2r,4r,5s)-4-azido-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-methylpyrimidine-2,4-dione
  • 1-[(2r,4r,5s)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4r,5s)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4r,5s)-4-azido-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone
  • 2,4(1h,3h)-pyrimidinedione, 1-(3-azido-2,3-dideoxy-.beta.-d-threo-pentofuranosyl)-5-methyl-
  • 2,4(1h,3h)-pyrimidinedione, 1-(3-azido-2,3-dideoxy-beta-d-threo-pentofuranosyl)-5-methyl-
  • azddxylot
  • azt (threo)
CAS Number(s)
  • 73971-82-1
InChIKey HBOMLICNUCNMMY-BWZBUEFSSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N