Description

2-Methyl-4-(Trifluoromethoxy)Iodobenzene is a high-value, multi-functional aromatic building block containing both iodine and a trifluoromethoxy substituent. This compound matters for its unique reactivity profile, where the iodine atom serves as an excellent handle for cross-coupling reactions, while the trifluoromethoxy group imparts desirable properties like enhanced metabolic stability and lipophilicity to final molecules. It is primarily needed by research and development chemists in the pharmaceutical and agrochemical industries for the synthesis of novel active ingredients, particularly in medicinal chemistry for lead optimization and in material science for advanced organic electronic materials.

Application

• Pharmaceutical Intermediate: A key precursor in Suzuki-Miyaura, Stille, and other palladium-catalyzed cross-couplings for constructing biaryl structures in drug discovery programs.
• Agrochemical Synthesis: Used in the development of novel herbicides, fungicides, and insecticides, where the CF3O- group can improve biological activity and environmental persistence.
• Material Science Research: Serves as a monomer or building block for synthesizing specialized polymers, liquid crystals, and organic semiconductors for OLEDs or photovoltaic applications.
• Fluorine Chemistry: An important substrate for studying the influence of the trifluoromethoxy group on chemical reactivity and physical properties in aromatic systems.
• Custom Synthesis & Contract Manufacturing: Supplied to CDMOs for the production of complex, high-value target molecules on gram to kilogram scale.
• Chemical Reference Standard: Used as an analytical standard in quality control laboratories for method development and validation.

Basic Information

Product Name	2-Methyl-4-(Trifluoromethoxy)Iodobenzene
CAS No.	886763-05-9
Molecular Formula	C9H6F3IO
Molecular Weight	314.05 g/mol
Synonyms	1-Iodo-2-methyl-4-(trifluoromethoxy)benzene; 4-Iodo-3-methylphenyl trifluoromethyl ether; 2-Methyl-1-iodo-4-(trifluoromethoxy)benzene; 3-Methyl-4-(trifluoromethoxy)iodobenzene; 4-(Trifluoromethoxy)-2-methyliodobenzene; 886763-05-9; 2-Methyl-4-(trifluoromethoxy)-1-iodobenzene
EINECS	Contact for details

Quality Control

Our 2-Methyl-4-(Trifluoromethoxy)Iodobenzene is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all specified parameters. Our quality commitment aligns with cGMP principles for advanced intermediates, ensuring reliability for your critical synthesis workflows.

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. For long-term storage, consider storing under an inert atmosphere such as argon or nitrogen to maintain optimal purity.

Specification

Item	Specification
Appearance	White to off-white crystalline solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Heavy Metals	< 20 ppm
Residual Solvents (GC)	Complies with ICH guidelines

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