N-Cyclohexyladenosine

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Properties Simple | Detailed

Formula C16H23N5O4
IUPAC Name (2r,3r,4s,5r)-2-[6-(cyclohexylamino)purin-9-ium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 349.385 g·mol−1
Heat of Formation -552.7 ± 16.7 kJ·mol−1
Dipole Moment 4.33 ± 1.08 D
Volume 399.44 Å 3
Surface Area 346.66 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-(cyclohexylamino)-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(cyclohexylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • pdsp1_000670
  • pdsp1_001023
  • pdsp1_001025
  • pdsp2_000660
  • pdsp2_001007
  • pdsp2_001009
InChIKey SZBULDQSDUXAPJ-XNIJJKJLSA-N
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