Description

Methyl 3-Cyano-5-(Trifluoromethoxy)Benzoate is a high-value, multi-functional aromatic ester building block designed for advanced chemical synthesis. Its molecular architecture, featuring both a cyano and a trifluoromethoxy substituent, makes it a critical intermediate for creating complex molecules with tailored electronic and steric properties. This compound is essential for R&D and production chemists in the pharmaceutical and agrochemical sectors, where it is used to develop novel active ingredients, particularly in medicinal chemistry for lead optimization and in crop protection research.

Application

• Pharmaceutical Intermediate: A key synthon for the development of active pharmaceutical ingredients (APIs), especially in the synthesis of molecules targeting central nervous system (CNS) disorders, inflammation, and metabolic diseases.
• Agrochemical Synthesis: Serves as a crucial building block for novel herbicides, fungicides, and insecticides, where the trifluoromethoxy group enhances biological activity and environmental stability.
• Liquid Crystal & OLED Materials: Used in the research and production of advanced electronic materials, where its aromatic core and polar substituents help fine-tune electro-optical properties.
• Organic Ligand Precursor: Acts as a starting material for synthesizing specialized ligands used in catalysis and metal-organic frameworks (MOFs).
• Fluorine Chemistry Research: An important compound for studying the introduction and effects of the trifluoromethoxy group in organic molecules.
• Custom Synthesis & Contract Manufacturing: Supplied to CDMOs and research institutions for proprietary synthesis projects requiring high-purity, complex intermediates.

Basic Information

Product Name	Methyl 3-Cyano-5-(Trifluoromethoxy)Benzoate
CAS No.	1306763-54-1
Molecular Formula	C10H6F3NO3
Molecular Weight	245.16 g/mol
Synonyms	Methyl 3-Cyano-5-(trifluoromethoxy)benzoate; Benzoic acid, 3-cyano-5-(trifluoromethoxy)-, methyl ester; 3-Cyano-5-(trifluoromethoxy)benzoic acid methyl ester; Methyl 3-cyano-5-(trifluoromethoxy)benzoate; 1306763-54-1; MFCD31812862
EINECS	Contact for details

Quality Control

Every batch of Methyl 3-Cyano-5-(Trifluoromethoxy)Benzoate is produced and tested under a strict quality management system. We guarantee high chemical purity and lot-to-lot consistency through advanced analytical techniques including HPLC, GC, NMR, and mass spectrometry. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with each shipment to ensure compliance with your research and production specifications.

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 strong oxidizing agents, strong bases, and sources of ignition. For long-term storage, consider under an inert atmosphere to maintain optimal purity.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 10 ppm

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