N-Allyl-N-Cyclohexyladenosine

Molecule SVG Image

Properties Simple | Detailed

Formula C19H27N5O4
IUPAC Name (2r,3r,4s,5r)-2-[6-[allyl(cyclohexyl)amino]purin-9-ium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 389.449 g·mol−1
Heat of Formation -461.7 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 457.16 Å 3
Surface Area 383.7 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-(allyl-cyclohexyl-amino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(allyl-cyclohexyl-amino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(allyl-cyclohexylamino)-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(cyclohexyl-prop-2-enyl-amino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-(cyclohexyl-prop-2-enylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • acha
  • adenosine, n-cyclohexyl-n-2-propenyl-
  • n(6)-allyl-n(6)-cyclohexyladenosine
CAS Number(s)
  • 55611-38-6
InChIKey JZKMIPDOAWBAHE-NVQRDWNXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N