Description

Methyl 3-amino-2,6-difluorobenzoate hydrochloride (CAS No. 1392273-41-4) is a high-purity benzoate derivative with the molecular formula C₈H₈ClF₂NO₂. This compound features a methyl ester group and an amino substituent on a difluorinated benzene ring, further stabilized as a hydrochloride salt. Its precise structure makes it a valuable intermediate in pharmaceutical synthesis, agrochemical development, and advanced material research. With exceptional purity (>98%) and consistent batch-to-batch quality, this product is ideal for researchers requiring reliable building blocks for heterocyclic chemistry, fluorinated drug design, or ligand preparation. Available in gram to kilogram quantities with optional analytical certificates (CoA, NMR, HPLC).

Properties

• CAS Number: 1392273-41-4
• Complexity: 201
• IUPAC Name: methyl 3-amino-2,6-difluoro-benzoate;hydrochloride
• InChI: InChI=1S/C8H7F2NO2.ClH/c1-13-8(12)6-4(9)2-3-5(11)7(6)10;/h2-3H,11H2,1H3;1H
• InChI Key: TWQXWBSPOVGBBW-UHFFFAOYSA-N
• Exact Mass: 223.0211625
• Molecular Formula: C8H8ClF2NO2
• Molecular Weight: 223.60
• SMILES: COC(=O)C1=C(C=CC(=C1F)N)F.Cl
• Topological: 52.3
• Monoisotopic Mass: 223.0211625
• Synonyms: Methyl 3-amino-2,6-difluorobenzoate hydrochloride, 1392273-41-4, methyl 3-amino-2,6-difluorobenzoate;hydrochloride, Benzoic acid, 3-amino-2,6-difluoro-, methyl ester, hydrochloride (1:1), Methyl3-amino-2,6-difluorobenzoatehydrochloride, DTXSID50720988, AKOS015919523, SB80046, DB-198546, CS-0301859, EN300-218389, Methyl 3-amino-2,6-difluorobenzoate–hydrogen chloride (1/1)

Application

Methyl 3-amino-2,6-difluorobenzoate hydrochloride serves as a key precursor in the synthesis of fluorinated pharmaceutical compounds, particularly kinase inhibitors and antibacterial agents. Its difluorinated aromatic core enables precise modulation of electronic properties in drug candidates. The hydrochloride salt form enhances stability for long-term storage and handling in synthetic workflows. Researchers utilize this compound in Suzuki-Miyaura couplings and nucleophilic aromatic substitution reactions.

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