Description

2,4-Dibromo-6-Trifluoromethoxyphenylisothiocyanate is a specialized halogenated aromatic isothiocyanate building block of significant interest in advanced organic synthesis. Its value lies in its unique molecular scaffold, which incorporates bromine substituents and a trifluoromethoxy group, enabling precise chemical modifications for creating novel compounds. This intermediate is primarily needed by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for the synthesis of active ingredients and functional materials.

Application

• Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of novel drug candidates, particularly those targeting specific enzyme inhibition or receptor modulation.
• Agrochemical Research: Used in the development of new pesticides and herbicides, where the bromine and trifluoromethoxy groups can contribute to biological activity and environmental stability.
• Ligand and Catalyst Development: Employed in the creation of specialized ligands for metal catalysis or as a building block for functionalized materials.
• Chemical Biology Probes: Acts as a reactive handle for bioconjugation, useful in creating probes for studying biological processes due to the isothiocyanate group's affinity for amines.
• Advanced Material Synthesis: Incorporated into polymers or small molecules designed for electronic or optical applications, leveraging its halogenated aromatic structure.
• Custom Synthesis and Contract Manufacturing: Supplied to CROs and CDMOs for client-specific research projects and scale-up campaigns requiring this specific halogenated motif.

Basic Information

Product Name	2,4-Dibromo-6-Trifluoromethoxyphenylisothiocyanate
CAS No.	886501-31-1
Molecular Formula	C8H2Br2F3NOS
Molecular Weight	378.97 g/mol
Synonyms	2,4-Dibromo-6-(trifluoromethoxy)phenyl isothiocyanate; 1,3-Dibromo-5-isothiocyanato-2-(trifluoromethoxy)benzene; 6-Trifluoromethoxy-2,4-dibromophenyl isothiocyanate; Isothiocyanic acid, 2,4-dibromo-6-(trifluoromethoxy)phenyl ester; 2,4-Dibromo-α,α,α-trifluoro-6-isothiocyanatoanisole
EINECS	Contact for details

Quality Control

Our products undergo rigorous quality testing to ensure compliance with industry standards for research and development. Each batch is characterized using advanced analytical techniques including HPLC, NMR, and mass spectrometry to confirm identity and purity. Certificates of Analysis (COA) detailing batch-specific results are available upon request. We adhere to a strict quality management system to ensure traceability and consistency for our global clientele.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept tightly sealed under an inert atmosphere (e.g., nitrogen or argon) after opening to prevent degradation. Keep away from incompatible materials such as strong bases and amines.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Heavy Metals	≤ 20 ppm

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