(5R)-6-{6-[(1E,3S,5Z)-3-Hydroxy-1,5-Undecadien-1-Yl]-2-Pyridinyl}-1,5-Hexanediol

Molecule SVG Image

Properties Simple | Detailed

Formula C22H35NO3
IUPAC Name (5r)-6-[6-[(1e,3s,5z)-3-hydroxyundeca-1,5-dienyl]-2-pyridyl]hexane-1,5-diol
Molecular Mass 361.518 g·mol−1
Heat of Formation -584.3 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 501.53 Å 3
Surface Area 411.29 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
Synonyms
  • (5r)-6-[6-[(1e,3s,5z)-3-hydroxyundeca-1,5-dienyl]-2-pyridyl]hexane-1,5-diol
  • (5r)-6-[6-[(1e,3s,5z)-3-hydroxyundeca-1,5-dienyl]pyridin-2-yl]hexane-1,5-diol
  • 6-[6-(3-hydroxy-1e,5z-undecadienyl)-2-pyridinyl]-1,5-hexanediol
InChIKey JNBOAUIJLDEICX-DWJNXXKWSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N