Description

[1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-pentyl-, 4-fluorophenyl ester (CAS No. 88878-50-6) is a high-purity synthetic ester compound with the molecular formula C₂₄H₃₅FO₂. This specialized chemical features a bicyclohexyl core substituted with a pentyl group and a 4-fluorophenyl ester moiety, offering unique steric and electronic properties. With an IUPAC name of (4-fluorophenyl) 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate, this compound is characterized by its trans,trans-configuration, which enhances its thermal stability and molecular rigidity. The presence of both aliphatic and aromatic components makes it particularly valuable for advanced material science applications. Available in >98% purity by HPLC, this product is supplied in amber glass vials under inert atmosphere to ensure long-term stability. Ideal for research in liquid crystal technology, organic electronics, and specialty polymer formulations.

Properties

• CAS Number: 88878-50-6
• Complexity: 428
• IUPAC Name: (4-fluorophenyl) 4-(4-pentylcyclohexyl)cyclohexanecarboxylate
• InChI: InChI=1S/C24H35FO2/c1-2-3-4-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)24(26)27-23-16-14-22(25)15-17-23/h14-21H,2-13H2,1H3
• InChI Key: ZVCPJOLFAYLVER-UHFFFAOYSA-N
• Exact Mass: 374.26210852
• Molecular Formula: C24H35FO2
• Molecular Weight: 374.5
• SMILES: CCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)F
• Topological: 26.3
• Monoisotopic Mass: 374.26210852
• Synonyms: 88878-50-6, (Trans,trans)-4-fluorophenyl 4′-pentyl-[1,1′-bi(cyclohexane)]-4-carboxylate, [1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-pentyl-, 4-fluorophenyl ester, TRANS,TRANS-4-FLUOROPHENYL 4”-PENTYLBICYCLOHEXYL-4-CARBOXYLATE, (4-fluorophenyl) 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate, TRANS,TRANS-4-FLUOROPHENYL 4′-PENTYLBICYCLOHEXYL-4-CARBOXYLATE, 4-Fluorophenyl trans,trans-4′-n-pentylbicyclohexyl-4-carboxylate, 5bcHCaAFP, MFCD29916896, SCHEMBL7511856, SCHEMBL8035948, SCHEMBL8380862, DTXSID20339703, AKOS032953579, CS-W011781, SB66838, DS-11418, F1120, 4-fluorophenyl 4-(4-pentylcyclohexyl)cyclohexanecarboxylate, 4-Fluorophenyl trans,trans-4′-Pentylbicyclohexyl-4-carboxylate, (Trans,trans)-4-fluorophenyl4′-pentyl-[1,1′-bi(cyclohexane)]-4-carboxylate

Application

This compound serves as a key intermediate in the synthesis of advanced liquid crystal materials for display technologies, where its rigid bicyclic structure and fluorinated aromatic group contribute to optimal mesomorphic properties. Researchers utilize it in the development of high-performance organic semiconductors due to its excellent charge transport characteristics. The material also finds use in specialty polymer additives where its thermal stability and molecular geometry can modify material properties.

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