Description

Methyl 3-Bromo-6-Cyano-2-Methylbenzoate is a high-purity, multi-functional aromatic ester building block designed for advanced synthetic chemistry. This compound is valued for its unique substitution pattern, offering reactive handles for bromination, cyanation, and esterification in a single molecule. It is primarily utilized by research chemists and process development scientists in the pharmaceutical and agrochemical industries for constructing complex heterocycles and active pharmaceutical ingredients (APIs). Its specific structure makes it a critical intermediate in medicinal chemistry programs targeting novel therapeutic agents.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of complex drug candidates, particularly in oncology and CNS research.
• Agrochemical Synthesis: Used in the development of novel herbicides, fungicides, and insecticides requiring specific halogenated aromatic cores.
• Material Science Research: Serves as a monomer or precursor for functionalized polymers and advanced organic materials.
• Ligand and Catalyst Development: Employed in the creation of specialized ligands for metal-catalyzed cross-coupling reactions.
• Chemical Biology Probes: Utilized to synthesize tagged molecules for studying biological pathways and target engagement.
• Custom Synthesis and Contract Manufacturing: Supplied to CDMOs for scale-up and production under cGMP conditions for clinical trials.

Basic Information

Product Name	Methyl 3-Bromo-6-Cyano-2-Methylbenzoate
CAS No.	1805488-00-9
Molecular Formula	C11H10BrNO2
Molecular Weight	268.11 g/mol
Synonyms	3-Bromo-6-cyano-2-methylbenzoic acid methyl ester; Methyl 3-bromo-6-cyano-o-toluate; Benzoic acid, 3-bromo-6-cyano-2-methyl-, methyl ester; 2-Methyl-3-bromo-6-cyanobenzoic acid methyl ester
EINECS	Contact for details

Quality Control

Our Methyl 3-Bromo-6-Cyano-2-Methylbenzoate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC for purity, NMR for structural confirmation, and GC-MS for solvent residue analysis, to ensure it meets the high standards required for research and development. Certificates of Analysis (COA) detailing all specifications are provided with every shipment and are available upon request.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). Keep away from strong oxidizing agents and bases. For long-term storage, consider storing under an inert atmosphere.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Residual Solvents (GC)	Complies with ICH guidelines
Water Content (KF)	≤ 0.5%

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