(2E,4E)-3-Methyl-5-{2-[(E)-2-(2,6,6-Trimethyl-1-Cyclohexen-1-Yl)Vinyl]-1-Cyclohexen-1-Yl}-2,4-Pentadienoic Acid

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Properties Simple | Detailed

Formula C23H32O2
IUPAC Name (2e,4e)-3-methyl-5-[2-[(e)-2-(2,6,6-trimethylcyclohexen-1-yl)vinyl]cyclohexen-1-yl]penta-2,4-dienoic acid
Molecular Mass 340.499 g·mol−1
Heat of Formation -383.4 ± 16.7 kJ·mol−1
Dipole Moment 3.50 ± 1.08 D
Volume 466.24 Å 3
Surface Area 384.31 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e)-3-methyl-5-[2-[(e)-2-(2,6,6-trimethyl-1-cyclohexenyl)ethenyl]-1-cyclohexenyl]penta-2,4-dienoic acid
  • (2e,4e)-3-methyl-5-[2-[(e)-2-(2,6,6-trimethyl-1-cyclohexenyl)vinyl]-1-cyclohexenyl]penta-2,4-dienoic acid
InChIKey IKRXMXPRKKQADW-SSQQRFAJSA-N
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