Description

3-Bromo-5-Fluoro-2-Iodobenzotrifluoride is a high-purity, multi-halogenated aromatic building block of significant importance in advanced organic synthesis. Its unique structure, featuring bromine, fluorine, iodine, and a trifluoromethyl group, makes it a versatile and valuable intermediate for constructing complex molecules. This compound is primarily sought after by research chemists and process development scientists in the pharmaceutical and agrochemical industries. It enables precise molecular modifications critical for developing new active ingredients with targeted properties.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of novel active pharmaceutical ingredients (APIs), particularly in drug discovery and development programs targeting CNS disorders, oncology, and anti-infectives.
• Agrochemical Synthesis: Used in the research and production of advanced herbicides, fungicides, and insecticides, where the introduction of halogen atoms can enhance biological activity and environmental stability.
• Material Science Precursor: Serves as a monomer or functionalization agent in the development of specialty polymers, liquid crystals, and organic electronic materials.
• Cross-Coupling Reactions: An excellent substrate for various metal-catalyzed cross-coupling reactions (e.g., Suzuki, Stille, Negishi) due to the presence of reactive bromo and iodo substituents, allowing for sequential functionalization.
• Fluorine Chemistry Research: A valuable compound for studying the effects of fluorine and trifluoromethyl groups on molecular conformation, lipophilicity, and metabolic stability in medicinal chemistry.
• Chemical Library Development: Employed in high-throughput and combinatorial chemistry to create diverse compound libraries for screening against biological targets.

Basic Information

Item	Details
Product Name	3-Bromo-5-Fluoro-2-Iodobenzotrifluoride
CAS No.	1027511-93-8
Molecular Formula	C7H2BrF4I
Molecular Weight	398.90 g/mol
Synonyms	2-Iodo-3-bromo-5-fluorobenzotrifluoride; 1-Bromo-3-fluoro-5-(trifluoromethyl)-2-iodobenzene; 3-Bromo-5-fluoro-α,α,α-trifluoro-2-iodotoluene; 2-Iodo-3-bromo-5-fluoro-α,α,α-trifluorotoluene; Benzene, 1-bromo-3-fluoro-5-(trifluoromethyl)-2-iodo-; 3-Bromo-5-fluoro-2-iodobenzotrifluoride; 3-Bromo-5-fluoro-2-iodo-α,α,α-trifluorotoluene
EINECS	Contact for details

Quality Control

Our 3-Bromo-5-Fluoro-2-Iodobenzotrifluoride is manufactured under strict quality management systems to ensure batch-to-batch consistency and high purity. Each lot undergoes comprehensive analytical testing, including HPLC, GC, NMR, and elemental analysis, to confirm identity and purity. A detailed Certificate of Analysis (COA) is provided with every shipment, documenting all critical quality attributes. We support cGMP and ISO compliant production for advanced research and development applications.

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 to maintain product integrity.

Specification

Item	Specification
Appearance	White to off-white crystalline powder or solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0% (Area %)
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

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