2-[2-(4-Methylphenyl)Ethoxy]Adenosine

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Formula C19H23N5O5
IUPAC Name (2r,3r,4s,5r)-2-[6-amino-2-[2-(p-tolyl)ethoxy]purin-9-ium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 401.416 g·mol−1
Heat of Formation -541.2 ± 16.7 kJ·mol−1
Dipole Moment 3.52 ± 1.08 D
Volume 468.26 Å 3
Surface Area 384.9 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • 2-(2-(4-methylphenyl)ethoxy)adenosine
  • 2-(2-(p-methylphenyl)ethoxy)adenosine
  • adenosine, 2-(2-(4-methylphenyl)ethoxy)-
  • sha 118
  • wrc 0090
  • wrc-0090
CAS Number(s)
  • 131865-94-6
InChIKey SRWUHMQKNPGXOP-SCFUHWHPSA-N
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