Description
4-Cyano-3-fluorophenyl 4-(4-ethylcyclohexyl)benzoate (CAS No. 92118-81-5) is a high-purity specialty chemical with the molecular formula C22H22FNO2. This compound, also known by its IUPAC name (4-cyano-3-fluorophenyl) 4-(4-ethylcyclohexyl)benzoate, is a structurally complex ester featuring a cyano-fluorophenyl moiety and an ethylcyclohexyl-substituted benzoate group. Its unique molecular architecture makes it valuable for advanced research in liquid crystal materials, organic electronics, and pharmaceutical intermediates. Available in >98% purity (HPLC), this product is rigorously tested for consistency and quality, ensuring reliable performance in sensitive applications. Supplied in amber glass vials under inert atmosphere to prevent degradation, it is ideal for researchers requiring precise control over material properties.
Properties
- CAS Number: 92118-81-5
- Complexity: 511
- IUPAC Name: (4-cyano-3-fluoro-phenyl) 4-(4-ethylcyclohexyl)benzoate
- InChI: InChI=1S/C22H22FNO2/c1-2-15-3-5-16(6-4-15)17-7-9-18(10-8-17)22(25)26-20-12-11-19(14-24)21(23)13-20/h7-13,15-16H,2-6H2,1H3
- InChI Key: FXUZUGKUGSWLJI-UHFFFAOYSA-N
- Exact Mass: 351.16345711
- Molecular Formula: C22H22FNO2
- Molecular Weight: 351.4
- SMILES: CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F
- Topological: 50.1
- Monoisotopic Mass: 351.16345711
- Synonyms: 92118-81-5, DTXSID60545760, 4-Cyano-3-fluorophenyl 4-(4-ethylcyclohexyl)benzoate, DTXCID40496544, 4-Cyano-3-fluorophenyl 4-(trans-4-ethylcyclohexyl)-benzoate, 4-Cyano-3-fluorophenyl 4-(trans-4-ethylcyclohexyl)benzoate, (4-cyano-3-fluorophenyl) 4-(4-ethylcyclohexyl)benzoate, 2cHBzoFCP, MFCD11053364, C22H22FNO2, SCHEMBL7516179, SCHEMBL8451896, SCHEMBL20152468, FXUZUGKUGSWLJI-UHFFFAOYSA-N, AKOS027250606, SB66980, DS-11805, CS-0153904, 4-Cyano-3-fluorophenyl trans-4-(4-ethylcyclohexyl)benzoate, 4-Cyano-3-fluorophenyl4-(trans-4-ethylcyclohexyl)benzoate
Application
This compound is primarily utilized in the development of advanced liquid crystal displays (LCDs) due to its mesogenic properties and stable thermal behavior. Researchers also employ it as a key intermediate in the synthesis of fluorinated organic electronic materials for OLED applications. Its unique structure makes it a candidate for studying structure-property relationships in polar aromatic esters.
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