N-(2-Hydroxyethyl)Adenosine

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Properties Simple | Detailed

Formula C12H17N5O5
IUPAC Name (2r,3r,4s,5r)-2-[6-(2-hydroxyethylamino)purin-9-ium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 311.294 g·mol−1
Heat of Formation -610.9 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 345.2 Å 3
Surface Area 314.0 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-(2-hydroxyethylamino)-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(2-hydroxyethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(2-hydroxyethylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(2-hydroxyethylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • 6-(2-hydroxyethyl)amino-9-beta-d-ribofuranosylpurine
  • pdsp1_001028
  • pdsp2_001012
CAS Number(s)
  • 32476-37-2
InChIKey BBOCDRLDMQHWJP-WOUKDFQISA-N
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