Description
4-[[6-[(1-Oxo-2-propenyl)oxy]hexyl]oxy]benzoic acid 4-ethylphenyl ester (CAS No. 558467-39-3) is a high-purity synthetic ester compound with the molecular formula C24H28O5. This specialized chemical, also known by its IUPAC name (4-ethylphenyl) 4-(6-prop-2-enoyloxyhexoxy)benzoate, is designed for advanced research applications in organic synthesis, liquid crystal technology, and polymer science. The compound features a unique molecular structure combining a benzoate ester core with an acrylate-terminated hexyloxy chain, offering dual reactivity for crosslinking and functionalization. Our product is rigorously characterized by HPLC, GC-MS, and NMR to ensure >98% purity, packaged under inert atmosphere to prevent degradation. Available in quantities from 100mg to 10g with customizable packaging options, this material is ideal for researchers developing photoactive polymers, liquid crystal displays (LCD), or advanced organic electronic materials. Store at 2-8°C in amber glass under argon.
Properties
- CAS Number: 558467-39-3
- Complexity: 487
- IUPAC Name: (4-ethylphenyl) 4-(6-prop-2-enoyloxyhexoxy)benzoate
- InChI: InChI=1S/C24H28O5/c1-3-19-9-13-22(14-10-19)29-24(26)20-11-15-21(16-12-20)27-17-7-5-6-8-18-28-23(25)4-2/h4,9-16H,2-3,5-8,17-18H2,1H3
- InChI Key: ZBUSNVSMNNRMRQ-UHFFFAOYSA-N
- Exact Mass: 396.19367399
- Molecular Formula: C24H28O5
- Molecular Weight: 396.5
- SMILES: CCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCOC(=O)C=C
- Topological: 61.8
- Monoisotopic Mass: 396.19367399
- Synonyms: 558467-39-3, 4-[[6-[(1-Oxo-2-propenyl)oxy]hexyl]oxy]benzoic acid 4-ethylphenyl ester, SCHEMBL12374426, ZBUSNVSMNNRMRQ-UHFFFAOYSA-N, DTXSID801170533, 4-Ethylphenyl 4-[[6-[(1-oxo-2-propen-1-yl)oxy]hexyl]oxy]benzoate
Application
This compound serves as a key intermediate in the synthesis of photoaligning materials for liquid crystal displays (LCDs), where its acrylate group enables UV-induced polymerization while the benzoate moiety provides alignment properties. Researchers utilize it to develop advanced polymer networks with controlled anisotropy for optical applications. The material also finds use in organic electronics as a building block for self-assembling monolayers with precisely tuned surface energies.
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