Description

1,2,4-Trifluoro-5-(trichloromethyl)benzene (CAS No. 136364-60-8) is a highly specialized halogenated aromatic compound with the molecular formula C₇H₂Cl₃F₃. This chemical features a benzene ring substituted with three fluorine atoms at the 1, 2, and 4 positions and a trichloromethyl group at the 5 position, offering unique reactivity for advanced synthetic applications. It is a valuable intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and liquid crystal materials. The compound is supplied as a high-purity reagent, ensuring optimal performance in demanding research and industrial processes. Proper handling under inert conditions is recommended due to its sensitivity to moisture and reactive functional groups.

Properties

• CAS Number: 136364-60-8
• Complexity: 182
• IUPAC Name: 1,2,4-trifluoro-5-(trichloromethyl)benzene
• InChI: InChI=1S/C7H2Cl3F3/c8-7(9,10)3-1-5(12)6(13)2-4(3)11/h1-2H
• InChI Key: QCDGLYXARUKIHR-UHFFFAOYSA-N
• Exact Mass: 247.917418
• Molecular Formula: C7H2Cl3F3
• Molecular Weight: 249.4
• SMILES: C1=C(C(=CC(=C1F)F)F)C(Cl)(Cl)Cl
• Monoisotopic Mass: 247.917418
• Synonyms: 136364-60-8, 1,2,4-Trifluoro-5-(trichloromethyl)benzene, 2,4,5-trifluorotrichloromethyl benzene, 2,4,5-Trifluorotrichloromethylbenzene, 2,4,5-Trifluoro Trichloromethyl Benzene, Benzene, 1,2,4-trifluoro-5-(trichloromethyl)-, SCHEMBL8975115, DTXSID60597385, AKOS015890409, 2,4,5-Trifluoro-(trichloromethyl)benzene

Application

1,2,4-Trifluoro-5-(trichloromethyl)benzene is widely utilized as a key building block in the synthesis of fluorinated aromatic compounds. Its reactivity makes it suitable for cross-coupling reactions, nucleophilic substitutions, and as a precursor for advanced materials. Researchers employ this compound in the development of active pharmaceutical ingredients (APIs) and specialty chemicals requiring precise fluorination patterns. Additionally, it serves as a critical intermediate in agrochemical research for crop protection agents.

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