Description

5-Iodo-2-Methylbenzotrifluoride is a versatile halogenated aromatic building block of significant interest in advanced organic synthesis. Its molecular structure, featuring both iodine and trifluoromethyl substituents, makes it a critical intermediate for constructing complex molecules with tailored electronic and steric properties. This compound is primarily sought after by research institutions and pharmaceutical companies for applications in medicinal chemistry, agrochemical development, and materials science.

Application

• Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of active pharmaceutical ingredients (APIs), particularly for compounds targeting central nervous system disorders and inflammation.
• Agrochemical Synthesis: Used in the development of novel herbicides, fungicides, and insecticides, where the trifluoromethyl group enhances biological activity and metabolic stability.
• Liquid Crystal & OLED Materials: Acts as a building block for advanced electronic materials, including liquid crystal displays (LCDs) and organic light-emitting diodes (OLEDs), due to its ability to modify molecular polarity and conformation.
• Cross-Coupling Reactions: The iodine atom makes it an excellent substrate for palladium-catalyzed cross-coupling reactions (e.g., Suzuki, Sonogashira) to form biaryl and other complex structures.
• Fluorine Chemistry Research: A valuable reagent for studying the introduction and effects of fluorine atoms in aromatic systems, which is crucial for modulating lipophilicity and bioavailability in drug design.
• Ligand & Catalyst Development: Utilized in the preparation of specialized ligands for catalysis and metal-organic frameworks (MOFs).

Basic Information

Product Name	5-Iodo-2-Methylbenzotrifluoride
CAS No.	930599-58-9
Molecular Formula	C8H6F3I
Molecular Weight	286.04 g/mol
Synonyms	2-Methyl-5-iodobenzotrifluoride; 1-Iodo-4-methyl-2-(trifluoromethyl)benzene; 5-Iodo-α,α,α-trifluoro-o-xylene; 2-(Trifluoromethyl)-5-iodotoluene; 3-Iodo-6-methylbenzotrifluoride; 5-Iodo-2-methyl-α,α,α-trifluorotoluene; 2-Methyl-α,α,α-trifluoro-5-iodotoluene
EINECS	Contact for details

Quality Control

Our 5-Iodo-2-Methylbenzotrifluoride is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC, GC, and NMR, to ensure high purity and consistency. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment to support your R&D and scale-up activities.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at room temperature (15-25°C). Keep away from heat, sparks, and open flame. Due to its light-sensitive nature, prolonged exposure to light should be avoided.

Specification

Item	Specification
Appearance	White to off-white crystalline powder or solid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Melting Point	Contact for details
Heavy Metals	< 10 ppm
Residue on Ignition	< 0.1%
Water Content (KF)	< 0.5%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.