4,4-Difluororetinoic Acid

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Formula C20H26F2O2
IUPAC Name (2e,4e,6e,8e)-9-(3,3-difluoro-2,6,6-trimethyl-cyclohexen-1-yl)-3,7-dimethyl-nona-2,4,6,8-tetraenoic acid
Molecular Mass 336.416 g·mol−1
Heat of Formation -766.4 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 430.22 Å 3
Surface Area 376.17 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e,6e,8e)-9-(3,3-difluoro-2,6,6-trimethyl-1-cyclohexenyl)-3,7-dimethyl-nona-2,4,6,8-tetraenoic acid
  • (2e,4e,6e,8e)-9-(3,3-difluoro-2,6,6-trimethyl-1-cyclohexenyl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid
  • 4,4-difluororetinoic acid (all-trans)
InChIKey MKEJTKXMLIOTOD-FRCNGJHJSA-N
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