Description
4-Cyano-3,5-difluorophenyl 4-ethyl-benzoate (CAS No. 337367-01-8) is a high-purity organic compound with the molecular formula C16H11F2NO2. This specialized ester derivative features a cyano group and fluorine substitutions on the phenyl ring, offering unique reactivity and stability for advanced synthetic applications. Its IUPAC name, (4-cyano-3,5-difluorophenyl) 4-ethylbenzoate, reflects its precise molecular structure. Ideal for researchers in materials science and pharmaceutical development, this compound is rigorously tested for consistency and supplied with comprehensive analytical data (HPLC, NMR, MS). Available in quantities from milligrams to kilograms, it is packaged under inert conditions to ensure long-term stability.
Properties
- CAS Number: 337367-01-8
- Complexity: 400
- IUPAC Name: (4-cyano-3,5-difluoro-phenyl) 4-ethylbenzoate
- InChI: InChI=1S/C16H11F2NO2/c1-2-10-3-5-11(6-4-10)16(20)21-12-7-14(17)13(9-19)15(18)8-12/h3-8H,2H2,1H3
- InChI Key: GELNXVAEDMBNNR-UHFFFAOYSA-N
- Exact Mass: 287.07578492
- Molecular Formula: C16H11F2NO2
- Molecular Weight: 287.26
- SMILES: CCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F
- Topological: 50.1
- Monoisotopic Mass: 287.07578492
- Synonyms: 337367-01-8, 4-Cyano-3,5-difluorophenyl 4-ethyl-benzoate, 4-Cyano-3,5-difluorophenyl 4-ethylbenzoate, (4-cyano-3,5-difluorophenyl) 4-ethylbenzoate, 2BzodFCP, SCHEMBL15284565, DTXSID50633564, MFCD11053372, 4-Cyano-3,5-difluorophenyl4-ethylbenzoate, CS-0451318, (4-Cyano-3,5-Difluoro-Phenyl) 4-Ethylbenzoate, 4-Ethyl-benzoic acid 4-cyano-3,5-difluoro-phenyl ester
Application
This compound serves as a versatile intermediate in the synthesis of liquid crystals and advanced organic materials, particularly for optoelectronic applications. Its fluorinated aromatic structure makes it valuable in pharmaceutical research for designing bioactive molecules with enhanced metabolic stability. Researchers also utilize it in polymer chemistry to modify thermal and optical properties of specialty resins.
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