2-(Hexyloxy)Adenosine

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Properties Simple | Detailed

Formula C16H25N5O5
IUPAC Name (2r,3r,4s,5r)-2-(6-amino-2-hexoxy-purin-9-ium-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 367.400 g·mol−1
Heat of Formation -731.7 ± 16.7 kJ·mol−1
Dipole Moment 2.60 ± 1.08 D
Volume 433.9 Å 3
Surface Area 391.17 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -0.40 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-(6-amino-2-hexoxy-9-purinyl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-(6-amino-2-hexoxy-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-(6-amino-2-hexoxy-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-(6-amino-2-hexoxy-purin-9-yl)-5-methylol-tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-(6-amino-2-hexoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
  • 2-hexyloxyadenosine
  • adenosine, 2-(hexyloxy)-
  • sha 125
  • sha-125
CAS Number(s)
  • 50257-95-9
InChIKey HMRUHHFLIMYEAF-SDBHATRESA-N
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