Description

Methyl 5-Nitro-2-(Trifluoromethyl)Benzoate is a high-value, multifunctional aromatic ester building block characterized by its nitro and trifluoromethyl substituents. This compound is essential for advanced organic synthesis, particularly in the development of complex molecules where its unique electronic and steric properties are leveraged. It is primarily sought after by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for creating novel active ingredients and functional materials.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of active pharmaceutical ingredients (APIs), especially those targeting central nervous system (CNS) disorders, inflammation, and oncology.
• Agrochemical Synthesis: Used in the research and development of novel herbicides, fungicides, and insecticides, where the trifluoromethyl group enhances biological activity and metabolic stability.
• Ligand and Catalyst Development: Serves as a starting material for creating specialized ligands and organocatalysts used in asymmetric synthesis and cross-coupling reactions.
• Material Science Research: Employed in the development of advanced polymers, liquid crystals, and organic electronic materials due to its aromatic core and functional handles.
• Fluorine Chemistry Studies: Acts as a model compound for investigating the influence of the trifluoromethyl group on reaction kinetics and molecular properties.
• Custom Synthesis and Contract Manufacturing: A critical building block for custom synthesis houses serving the life sciences sector, enabling the production of bespoke molecules for client projects.

Basic Information

Product Name	Methyl 5-Nitro-2-(Trifluoromethyl)Benzoate
CAS No.	1214328-90-1
Molecular Formula	C9H6F3NO4
Molecular Weight	249.14 g/mol
Synonyms	Methyl 5-nitro-2-(trifluoromethyl)benzoate; 5-Nitro-2-(trifluoromethyl)benzoic acid methyl ester; Benzoic acid, 5-nitro-2-(trifluoromethyl)-, methyl ester; Methyl 5-nitro-α,α,α-trifluoro-o-toluate; 2-(Trifluoromethyl)-5-nitrobenzoic acid methyl ester
EINECS	Contact for details

Quality Control

Our Methyl 5-Nitro-2-(Trifluoromethyl)Benzoate is manufactured under strict quality management systems. Every batch undergoes comprehensive analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure high purity and batch-to-batch consistency. We provide a detailed Certificate of Analysis (COA) with each shipment, documenting identity, purity, and impurity profiles. Our quality commitment supports applications in GMP-intermediate and research-grade synthesis.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at controlled room temperature (15-25°C). Keep away from heat, sparks, and open flame. This material is light-sensitive (store away from light).

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 20 ppm

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