N-(4-Azidobenzyl)Adenosine

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Properties Simple | Detailed

Formula C17H18N8O4
IUPAC Name (2r,3r,4s,5r)-2-[6-[(4-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 398.376 g·mol−1
Heat of Formation -43.9 ± 16.7 kJ·mol−1
Dipole Moment 2.97 ± 1.08 D
Volume 441.65 Å 3
Surface Area 391.76 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.05 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-[(4-azidobenzyl)amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-[(4-azidophenyl)methylamino]-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-[(4-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-[(4-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • ab-adenosine
  • adenosine, n-((4-azidophenyl)methyl)-
  • n(6)-(4-azidobenzyl)adenosine
  • n(6)-(p-azidobenzyl)adenosine
CAS Number(s)
  • 85107-83-1
InChIKey LJEKWNMXSDUSRF-LSCFUAHRSA-N
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