Description

1-(Chlorodifluoromethyl)-2-fluorobenzene (CAS No. 17054-13-6) is a high-purity fluorinated aromatic compound with the molecular formula C₇H₄ClF₃. This specialty chemical features a chlorodifluoromethyl group ortho to a fluorine substituent on a benzene ring, offering unique reactivity for advanced synthetic applications. Ideal for researchers in pharmaceutical, agrochemical, and materials science fields, this compound serves as a versatile building block for introducing fluorinated motifs. Supplied as a clear, colorless to pale yellow liquid with >95% purity (GC), it is packaged under inert gas to ensure stability. Store in a cool, dry place away from strong oxidizers and bases. For research use only – not intended for human or veterinary applications.

Properties

• CAS Number: 17054-13-6
• Complexity: 138
• IUPAC Name: 1-[chloro(difluoro)methyl]-2-fluoro-benzene
• InChI: InChI=1S/C7H4ClF3/c8-7(10,11)5-3-1-2-4-6(5)9/h1-4H
• InChI Key: MAPGNFOESSJGBG-UHFFFAOYSA-N
• Exact Mass: 179.9953623
• Molecular Formula: C7H4ClF3
• Molecular Weight: 180.55
• SMILES: C1=CC=C(C(=C1)C(F)(F)Cl)F
• Monoisotopic Mass: 179.9953623
• Synonyms: 1-(Chlorodifluoromethyl)-2-fluorobenzene, 17054-13-6, 1-[Chloro(difluoro)methyl]-2-fluorobenzene, 1-(CHLOROCIFLUOROMETHYL)-2-FLUOROBENZENE, SCHEMBL5668721, DTXSID10623820, MAPGNFOESSJGBG-UHFFFAOYSA-N, MFCD14892602, AKOS024438263, PS-10663, DB-190631, CS-0211627

Application

This fluorinated benzene derivative is widely utilized as a key intermediate in the synthesis of bioactive molecules, particularly in the development of pharmaceuticals and agrochemicals. Its unique substitution pattern enables selective functionalization for creating novel fluorinated compounds. Researchers also employ this chemical in materials science for modifying polymer properties and developing advanced fluorinated coatings. The compound’s reactivity makes it valuable for studying nucleophilic aromatic substitution reactions in organofluorine chemistry.

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