2-(2-Cyclohexylethoxy)Adenosine

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Properties Simple | Detailed

Formula C18H27N5O5
IUPAC Name (2r,3r,4s,5r)-2-[6-amino-2-(2-cyclohexylethoxy)purin-9-ium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 393.437 g·mol−1
Heat of Formation -725.0 ± 16.7 kJ·mol−1
Dipole Moment 1.00 ± 1.08 D
Volume 456.69 Å 3
Surface Area 400.85 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-amino-2-(2-cyclohexylethoxy)-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-(2-cyclohexylethoxy)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-(2-cyclohexylethoxy)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-(2-cyclohexylethoxy)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • adenosine, 2-(2-cyclohexylethoxy)-
  • sha 91
  • wrc 0013
  • wrc-0013
CAS Number(s)
  • 131933-18-1
InChIKey VHMUQIWMOXQFBP-LSCFUAHRSA-N
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