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Atomfair [1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-propyl-, 4-pentylcyclohexyl ester C27H48O2 CAS 102714-92-1

[1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-propyl-, 4-pentylcyclohexyl ester (CAS No. 102714-92-1) is a high-purity, synthetic organic compound with the molecular formula C27H48O2. This ester derivative features a bicyclohexyl core functionalized with propyl and pentylcyclohexyl groups, offering unique steric and electronic properties for advanced research applications. Its IUPAC name, (4-pentylcyclohexyl) 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate, reflects its precise structural configuration. Ideal for liquid […]

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Description

[1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-propyl-, 4-pentylcyclohexyl ester (CAS No. 102714-92-1) is a high-purity, synthetic organic compound with the molecular formula C27H48O2. This ester derivative features a bicyclohexyl core functionalized with propyl and pentylcyclohexyl groups, offering unique steric and electronic properties for advanced research applications. Its IUPAC name, (4-pentylcyclohexyl) 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate, reflects its precise structural configuration. Ideal for liquid crystal studies, material science, and organic synthesis, this compound is rigorously characterized by GC/MS, NMR, and HPLC to ensure ≥95% purity. Packaged under inert gas in amber glass vials to prevent degradation.

Properties

  • CAS Number: 102714-92-1
  • Complexity: 449
  • IUPAC Name: (4-pentylcyclohexyl) 4-(4-propylcyclohexyl)cyclohexanecarboxylate
  • InChI: InChI=1S/C27H48O2/c1-3-5-6-8-22-11-19-26(20-12-22)29-27(28)25-17-15-24(16-18-25)23-13-9-21(7-4-2)10-14-23/h21-26H,3-20H2,1-2H3
  • InChI Key: PRTUNEBYYBLURD-UHFFFAOYSA-N
  • Exact Mass: 404.365430770
  • Molecular Formula: C27H48O2
  • Molecular Weight: 404.7
  • SMILES: CCCCCC1CCC(CC1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC
  • Topological: 26.3
  • Monoisotopic Mass: 404.365430770
  • Synonyms: [1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-propyl-, 4-pentylcyclohexyl ester, SCHEMBL9502512, SCHEMBL9502518, SCHEMBL9560921, SCHEMBL9561904, PRTUNEBYYBLURD-ZYMDQYHBSA-N, DTXSID601133606, 102714-92-1, trans-4-Pentylcyclohexyl (trans,trans)-4a(2)-propyl[1,1a(2)-bicyclohexyl]-4-carboxylate

Application

This compound is primarily investigated as a potential mesogen in liquid crystal displays (LCDs) due to its rigid cyclohexyl backbone and alkyl tail modifications. Researchers utilize it to study phase transition behavior and dielectric anisotropy in nematic or smectic phases. It may also serve as an intermediate in the synthesis of complex steroidal analogs or surfactant systems.

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Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

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Certain molecules may be protected by active patents or regulatory restrictions.

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