Alitretinoin

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Properties Simple | Detailed

Formula C20H28O2
IUPAC Name (2e,4e,6z,8e)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid
Molecular Mass 300.435 g·mol−1
Heat of Formation -351.1 ± 16.7 kJ·mol−1
Dipole Moment 4.05 ± 1.08 D
Volume 420.42 Å 3
Surface Area 352.63 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e,6z,8e)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid
  • 9 cis retinoic acid
  • 9-cis-ra
  • 9-cra
  • agn-192013
  • alrt-1057
  • bal-4079
  • bb_nc-1005
  • lg-100057
  • lgd-1057
  • lmpr01090022
  • ls-1328
  • ro-04-4079
InChIKey SHGAZHPCJJPHSC-ZVCIMWCZSA-N
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