Description

Bicyclo[2.2.2]Octane-1-Carboxylic Acid, 4-[4-Methyl-5-[2-(Trifluoromethyl)Phenyl]-4H-1,2,4-Triazol-3-Yl]-, Methyl Ester is a high-value, structurally complex organic intermediate that combines a rigid bicyclic framework with a functionalized triazole moiety. This compound matters for its role as a critical building block in advanced pharmaceutical research and agrochemical development, enabling the synthesis of novel active ingredients. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries seeking to create new molecules with enhanced properties.

Application

• Pharmaceutical Intermediate: Key synthon for the research and development of new drug candidates, particularly in central nervous system (CNS) and oncology therapeutic areas.
• Agrochemical Active Ingredient Precursor: Used in the synthesis of novel herbicides, fungicides, or insecticides leveraging its unique steric and electronic profile.
• Ligand Synthesis for Catalysis: Serves as a precursor for creating sophisticated ligands used in asymmetric catalysis and transition metal complexes.
• Material Science Research: Building block for advanced polymers or organic electronic materials due to its rigid, three-dimensional structure.
• Chemical Biology Probe Development: Utilized in creating molecular probes to study enzyme function or protein-protein interactions.
• Custom Synthesis and Contract Manufacturing: Supplied to CROs and CDMOs for client-specific synthetic projects requiring high-purity, complex intermediates.

Basic Information

Product Name	Bicyclo[2.2.2]Octane-1-Carboxylic Acid, 4-[4-Methyl-5-[2-(Trifluoromethyl)Phenyl]-4H-1,2,4-Triazol-3-Yl]-, Methyl Ester
CAS No.	719274-90-5
Molecular Formula	C20H20F3N3O2
Molecular Weight	391.39 g/mol
Synonyms	Methyl 4-(4-methyl-5-(2-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)bicyclo[2.2.2]octane-1-carboxylate; Bicyclo[2.2.2]octane-1-carboxylic acid, 4-(4-methyl-5-(2-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)-, methyl ester; 719274-90-5; 4-(4-Methyl-5-(2-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)bicyclo[2.2.2]octane-1-carboxylic acid methyl ester
EINECS	Contact for details

Quality Control

Our production of Bicyclo[2.2.2]Octane-1-Carboxylic Acid, 4-[4-Methyl-5-[2-(Trifluoromethyl)Phenyl]-4H-1,2,4-Triazol-3-Yl]-, Methyl Ester adheres to stringent quality management protocols. Every batch undergoes rigorous analytical testing, including HPLC, NMR, and MS, to ensure identity, purity, and consistency. Certificates of Analysis (COA) detailing all specifications are provided with each shipment. We support compliance with cGMP and ICH guidelines for pharmaceutical intermediates, ensuring traceability and documentation for regulatory submissions.

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). This product is hygroscopic (moisture-sensitive) and light-sensitive; therefore, containers must be kept sealed under an inert atmosphere (e.g., nitrogen or argon) when not in use to prevent degradation. Keep away from incompatible materials.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 10 ppm
Single Unknown Impurity (HPLC)	≤ 0.5%

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