Description

Methyl 3-([[3-(Trifluoromethyl)Phenyl]Thio]Methyl)Benzoate is a high-purity synthetic intermediate characterized by its unique trifluoromethyl and thioether functional groups. This compound is valued for its role in facilitating complex molecular transformations, particularly in the development of advanced materials and active pharmaceutical ingredients. It is primarily sought by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for constructing novel molecular architectures.

Application

• Pharmaceutical Intermediate: Key building block in the synthesis of novel drug candidates, especially those targeting central nervous system (CNS) disorders and inflammatory diseases.
• Agrochemical Synthesis: Used in the research and development of next-generation herbicides and fungicides, leveraging the stability imparted by the trifluoromethyl group.
• Ligand and Catalyst Development: Serves as a precursor for creating specialized ligands in transition metal catalysis and organocatalysis.
• Material Science Research: Employed in the development of organic electronic materials and liquid crystals due to its specific electronic properties.
• Custom Synthesis and Contract Manufacturing: Supplied to CROs and CDMOs for client-specific projects requiring this precise chemical scaffold.

Basic Information

Product Name	Methyl 3-([[3-(Trifluoromethyl)Phenyl]Thio]Methyl)Benzoate
CAS No.	650617-47-3
Molecular Formula	C16H13F3O2S
Molecular Weight	326.34 g/mol
Synonyms	Benzoic acid, 3-[[[3-(trifluoromethyl)phenyl]thio]methyl]-, methyl ester; Methyl 3-(((3-(Trifluoromethyl)phenyl)thio)methyl)benzoate; 3-[[[3-(Trifluoromethyl)phenyl]thio]methyl]benzoic acid methyl ester; m-(((3-Trifluoromethyl)phenyl)thiomethyl)benzoic acid methyl ester
EINECS	Contact for details

Quality Control

Every batch of Methyl 3-([[3-(Trifluoromethyl)Phenyl]Thio]Methyl)Benzoate is produced and tested under a strict quality management system. We provide comprehensive analytical data to ensure the material meets the high standards required for research and scale-up activities. A detailed Certificate of Analysis (COA), including purity by HPLC, identity confirmation (IR, NMR), and impurity profile, is supplied with each shipment to guarantee traceability and consistency.

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). Due to its sensitivity, the container should be kept under an inert atmosphere (e.g., nitrogen or argon) to prevent oxidation and moisture ingress. Keep away from heat, sparks, and open flame.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
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.