(2Z)-{3-[(1Z,3E)-2-Methyl-4-(2,6,6-Trimethyl-1-Cyclohexen-1-Yl)-1,3-Butadien-1-Yl]-2-Cyclohexen-1-Ylidene}Acetaldehyde

Molecule SVG Image

Properties Simple | Detailed

Formula C22H30O
IUPAC Name (2z)-2-[3-[(1z,3e)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]cyclohex-2-en-1-ylidene]acetaldehyde
Molecular Mass 310.473 g·mol−1
Heat of Formation -118.0 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 442.5 Å 3
Surface Area 337.17 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.87 ± eV
Point Group Symmetry C1
Synonyms
  • (2z)-2-[3-[(1z,3e)-2-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)buta-1,3-dienyl]-1-cyclohex-2-enylidene]ethanal
  • 11,20-ethanoretinal
  • br6.11
  • retinal 6.11
CAS Number(s)
  • 102586-39-0
InChIKey FOYUFPJPFUUNOX-ZZSFXEBMSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O