Description

4-Iodo-2,6-dimethylaniline (CAS: 4102-53-8) is a high-purity organic compound with the molecular formula C₈H₁₀IN. This halogenated aniline derivative is characterized by its iodine substitution at the para position and two methyl groups at the ortho positions, making it a valuable intermediate in synthetic organic chemistry. Its crystalline form and stability under standard conditions ensure reliable performance in research and industrial applications. Ideal for use in pharmaceuticals, agrochemicals, and material science, this compound is rigorously tested for purity (typically ≥95-98%) via HPLC, GC, or NMR to meet stringent laboratory standards. Available in scalable quantities from milligrams to kilograms, it is packaged under inert conditions to maintain integrity.

Properties

• CAS Number: 4102-53-8
• Complexity: 104
• IUPAC Name: 4-iodo-2,6-dimethyl-aniline
• InChI: InChI=1S/C8H10IN/c1-5-3-7(9)4-6(2)8(5)10/h3-4H,10H2,1-2H3
• InChI Key: BJJSUOOEBCCLNY-UHFFFAOYSA-N
• Exact Mass: 246.98580
• Molecular Formula: C8H10IN
• Molecular Weight: 247.08
• SMILES: CC1=CC(=CC(=C1N)C)I
• Topological: 26
• Monoisotopic Mass: 246.98580
• Synonyms: 4-Iodo-2,6-dimethylaniline, 4102-53-8, 2,6-dimethyl-4-iodoaniline, Benzenamine, 4-iodo-2,6-dimethyl-, 4-iodo-2,6-dimethylbenzenamine, MFCD08061611, NSC-128900, 4-Iodo-2,6-dimethyl-phenylamine hydrochloride, NSC128900, DBC8AYX76Q, 2,6-Xylidine, 4-iodo-, SCHEMBL106150, 4-iodo-2,6-dimethylphenylamine, 4-iodo-2,6-dimethyl benzenamine, DTXSID00299250, CS-M3088, SBB051715, AKOS015889977, AC-1378, NSC 128900, AS-17338, SY035113, DB-024418

4-Iodo-2,6-dimethylaniline serves as a versatile building block in the synthesis of complex organic molecules, particularly in pharmaceutical research for developing iodinated drug candidates. Its structural features enable participation in cross-coupling reactions (e.g., Suzuki, Heck) to construct biaryl scaffolds. Additionally, it is employed in agrochemical formulations and as a precursor for dyes or ligands in catalysis. Researchers value its predictable reactivity and compatibility with diverse reaction conditions.

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