9-(2-Deoxy-β-D-Threo-Pentofuranosyl)-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C10H13N5O3
IUPAC Name (2r,3r,5r)-5-(6-aminopurin-9-ium-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
Molecular Mass 251.242 g·mol−1
Heat of Formation -314.7 ± 16.7 kJ·mol−1
Dipole Moment 2.09 ± 1.08 D
Volume 274.14 Å 3
Surface Area 242.62 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy 2.39 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,5r)-5-(6-amino-9-purinyl)-2-(hydroxymethyl)-3-tetrahydrofuranol
  • (2r,3r,5r)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
  • (2r,3r,5r)-5-(6-aminopurin-9-yl)-2-methylol-tetrahydrofuran-3-ol
  • 1-(2'-deoxy-beta-d-threopentofuranosyl)adenine
  • 1-(2'-deoxy-beta-threopentofuranosyl)adenine
  • 1-dpfa
  • 2'-da threo
  • 2'deoxyadenosine b-d-threo
  • 9-(2-deoxy-.beta.-d-threo-pentofuranosyl)adenine
  • 9h-purin-6-amine, 9-(2-deoxy-b-d-threo-pentofuranosyl)-
  • 9h-purin-6-amine, 9-(2-deoxy-beta-d-threo-pentofuranosyl)-
CAS Number(s)
  • 13006-70-7
  • 13276-53-4
InChIKey OLXZPDWKRNYJJZ-FSDSQADBSA-N
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