{(2S,5S)-5-[6-(Cyclohexylamino)-9H-Purin-9-Yl]Tetrahydro-2-Furanyl}Methanol

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Properties Simple | Detailed

Formula C16H23N5O2
IUPAC Name [(2s,5s)-5-[6-(cyclohexylamino)purin-9-ium-9-yl]tetrahydrofuran-2-yl]methanol
Molecular Mass 317.386 g·mol−1
Heat of Formation -202.8 ± 16.7 kJ·mol−1
Dipole Moment 2.42 ± 1.08 D
Volume 381.56 Å 3
Surface Area 337.78 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • 2',3'-dideoxy-n(6)-cyclohexyladenosine
  • 2',3'-dideoxycyclohexyladenosine
  • [(2s,5s)-5-[6-(cyclohexylamino)-9-purinyl]-2-tetrahydrofuranyl]methanol
  • [(2s,5s)-5-[6-(cyclohexylamino)purin-9-yl]oxolan-2-yl]methanol
  • [(2s,5s)-5-[6-(cyclohexylamino)purin-9-yl]tetrahydrofuran-2-yl]methanol
  • pdsp1_001850
  • pdsp2_001832
CAS Number(s)
  • 118191-22-3
InChIKey VNLBSPUULCIVCQ-STQMWFEESA-N
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