Description

3-Pyridinecarboxylic Acid, 6-(Trifluoromethyl)-, 3-[[(Phenylmethyl)Amino]Carbonyl]Phenyl Ester is a specialized, high-value chemical intermediate characterized by its pyridine core and trifluoromethyl substituent. This compound matters for its role in facilitating complex molecular synthesis, particularly in the development of advanced materials and active pharmaceutical ingredients (APIs) where the introduction of fluorine atoms is critical for modulating biological activity and stability. It is primarily needed by research institutions and industrial manufacturers in the pharmaceutical, agrochemical, and advanced material science sectors for constructing novel molecular architectures.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of novel drug candidates, especially those targeting central nervous system (CNS) disorders, due to the bioactivity-enhancing properties of the pyridine and trifluoromethyl groups.
• Agrochemical Research: Used in developing next-generation pesticides and herbicides, where the fluorine moiety improves compound lipophilicity, metabolic stability, and membrane penetration.
• Ligand and Catalyst Development: Serves as a precursor for creating specialized ligands in catalytic systems or as a core structure in metal-organic frameworks (MOFs) for material science applications.
• Organic Electronics: Potential use in the synthesis of electron-deficient components for organic light-emitting diodes (OLEDs) or semiconductors, leveraging its aromatic and fluorinated structure.
• Fluorine Chemistry Research: An important reagent for academic and industrial research focused on incorporating trifluoromethyl groups into complex organic molecules.
• Custom Synthesis and Contract Manufacturing: Supplied to CDMOs (Contract Development and Manufacturing Organizations) for the production of bespoke compounds for client-specific R&D projects.

Basic Information

Product Name	3-Pyridinecarboxylic Acid, 6-(Trifluoromethyl)-, 3-[[(Phenylmethyl)Amino]Carbonyl]Phenyl Ester
CAS No.	941158-45-8
Molecular Formula	C21H15F3N2O3
Molecular Weight	400.35 g/mol
Synonyms	6-(Trifluoromethyl)nicotinic acid 3-[(benzylcarbamoyl)]phenyl ester; 3-[[(Phenylmethyl)amino]carbonyl]phenyl 6-(trifluoromethyl)pyridine-3-carboxylate; 3-(Benzylcarbamoyl)phenyl 6-(trifluoromethyl)nicotinate; Benzyl-carbamic acid 3-[6-(trifluoromethyl)pyridine-3-carbonyloxy]phenyl ester; 941158-45-8; 3-Pyridinecarboxylic acid, 6-(trifluoromethyl)-, 3-[(phenylmethyl)carbamoyl]phenyl ester
EINECS	Contact for details

Quality Control

Our production of 3-Pyridinecarboxylic Acid, 6-(Trifluoromethyl)-, 3-[[(Phenylmethyl)Amino]Carbonyl]Phenyl Ester adheres to stringent quality management protocols to ensure batch-to-batch consistency and high purity for research and development applications. All materials undergo rigorous analytical testing, including HPLC, NMR, and MS, to confirm identity and purity. A comprehensive Certificate of Analysis (COA) detailing purity, assay, and impurity profiles is provided with each shipment to support your quality assurance and regulatory documentation needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). This compound may be moisture-sensitive; keep the container tightly sealed in a dry environment. For long-term storage, consider storing under an inert atmosphere to maintain stability.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 97.0%
Assay	≥ 97.0% (by HPLC)
Water Content (KF)	≤ 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.