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CAS 132123-45-6

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TRANS,TRANS-3,4,5-TRIFLUOROPHENYL 4'-PROPYLBICYCLOHEXYL-4-CARBOXYLATE

Description:
TRANS,TRANS-3,4,5-Trifluorophenyl 4'-propylbicyclohexyl-4-carboxylate is a chemical compound characterized by its complex structure, which includes a trifluorophenyl group and a bicyclohexyl moiety. The presence of trifluoromethyl groups typically enhances the lipophilicity and metabolic stability of the compound, making it potentially useful in various applications, including pharmaceuticals and agrochemicals. The bicyclohexyl structure contributes to its rigidity and may influence its biological activity and interaction with target molecules. This compound is likely to exhibit unique physical and chemical properties, such as specific solubility characteristics and reactivity patterns, influenced by the fluorine atoms and the ester functional group. Additionally, the presence of the carboxylate group suggests potential for ionic interactions, which could be relevant in biological systems. Overall, the unique combination of functional groups and structural features makes this compound of interest for further research and application in various fields of chemistry and material science.
Formula:C22H29F3O2
InChI:InChI=1/C22H29F3O2/c1-2-3-14-4-6-15(7-5-14)16-8-10-17(11-9-16)22(26)27-18-12-19(23)21(25)20(24)13-18/h12-17H,2-11H2,1H3/t14-,15-,16-,17-
InChI key:InChIKey=SDAWLPKKYZMFEM-GARHLSDINA-N
SMILES:C(OC1=CC(F)=C(F)C(F)=C1)(=O)[C@H]2CC[C@@](CC2)([C@]3(CC[C@H](CCC)CC3)[H])[H]
Synonyms:
  • 3,4,5-Trifluorophenyl 4'-propyl-1,1'-bi(cyclohexyl)-4-carboxylate
  • 3-Hheb(F,F)-F
  • Cczu 3F
  • [1,1'-Bicyclohexyl]-4-Carboxylic Acid, 4'-Propyl-, 3,4,5-Trifluorophenyl Ester
  • [1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-propyl-, 3,4,5-trifluorophenyl ester, (trans,trans)-
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