(4E,8E)-10-(4,5-Dimethoxy-2-Methyl-3,6-Dioxo-1,4-Cyclohexadien-1-Yl)-4,8-Dimethyl-4,8-Decadienoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C21H28O6
IUPAC Name (4e,8e)-10-(4,5-dimethoxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)-4,8-dimethyl-deca-4,8-dienoic acid
Molecular Mass 376.443 g·mol−1
Heat of Formation -942.8 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 472.02 Å 3
Surface Area 353.03 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -1.59 ± eV
Point Group Symmetry C1
Synonyms
  • (4e,8e)-10-(3,6-diketo-4,5-dimethoxy-2-methyl-1-cyclohexa-1,4-dienyl)-4,8-dimethyl-deca-4,8-dienoic acid
  • (4e,8e)-10-(4,5-dimethoxy-2-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)-4,8-dimethyl-deca-4,8-dienoic acid
  • (4e,8e)-10-(4,5-dimethoxy-2-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)-4,8-dimethyldeca-4,8-dienoic acid
  • 4,8-decadienoic acid, 10-(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)-4,8-dimethyl, (e,e)-
  • t 22083
  • t-22083
CAS Number(s)
  • 85228-87-1
InChIKey PZGGRDOEBBMXHC-UAUIHIKDSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O