Description

Benzene, 4-Bromo-2-Isothiocyanato-1-Methyl- (9Ci) is a specialized aromatic compound featuring both bromo and isothiocyanato functional groups on a methyl-substituted benzene ring. This unique bifunctional structure makes it a valuable high-purity building block for advanced organic synthesis and pharmaceutical research. It is primarily utilized by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and material science industries to create novel molecular entities.

Application

• Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of novel active pharmaceutical ingredients (APIs), particularly those targeting specific biological pathways.
• Agrochemical Research: Used in the development of new herbicides, fungicides, and insecticides, leveraging its reactive sites for structural diversification.
• Ligand and Probe Synthesis: The isothiocyanato group is instrumental for creating fluorescent probes, affinity labels, and chelating ligands for biochemical and diagnostic applications.
• Material Science: Acts as a monomer or cross-linking agent in the development of advanced polymers and functional organic materials.
• Chemical Biology: Employed in activity-based protein profiling (ABPP) and other chemoproteomic studies to investigate enzyme function and discover new drug targets.
• Academic & Industrial R&D: A versatile reagent for methodological development and exploring new chemical reactions in synthetic organic chemistry.

Basic Information

Product Name	Benzene, 4-Bromo-2-Isothiocyanato-1-Methyl- (9Ci)
CAS No.	597545-18-1
Molecular Formula	C9H6BrNS
Molecular Weight	240.12 g/mol
Synonyms	4-Bromo-2-isothiocyanato-1-methylbenzene; 2-Methyl-5-bromophenyl isothiocyanate; 1-Bromo-4-isothiocyanato-3-methylbenzene; 5-Bromo-2-methylphenyl isothiocyanate; 4-Bromo-2-methylphenyl isothiocyanate; 2-Methyl-5-bromo-phenyl isothiocyanate
EINECS	Contact for details

Quality Control

We supply Benzene, 4-Bromo-2-Isothiocyanato-1-Methyl- (9Ci) in high-purity grades suitable for research and development. Our products undergo rigorous quality testing to ensure batch-to-batch consistency and compliance with industry standards. Certificates of Analysis (COA) detailing purity, identity, and impurity profiles are available upon request to support your quality assurance protocols.

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). This compound is moisture-sensitive; keep the container tightly sealed under an inert atmosphere if necessary. Keep away from strong bases and oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details

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