Description

4-Isoxazolecarboxylic Acid, 3-Phenyl-5-[[(Phenylmethyl)Amino]Methyl]- is a specialized heterocyclic compound featuring a unique isoxazole core functionalized with carboxylic acid, phenyl, and benzylamino-methyl groups. This molecular architecture makes it a valuable high-purity building block for advanced organic synthesis and pharmaceutical research. It is primarily utilized by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and fine chemical industries for creating novel active compounds and complex molecular scaffolds.

Application

• Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders or possessing anti-inflammatory properties.
• Agrochemical Research: Used in the development of new herbicides, fungicides, or insecticides, leveraging its heterocyclic structure for bioactivity.
• Ligand Synthesis: Acts as a starting material for creating complex chelating ligands used in catalysis or metal-organic frameworks (MOFs).
• Fine Chemical Production: Employed in the multi-step synthesis of specialty chemicals, dyes, and advanced materials.
• Academic & Institutional R&D: A valuable reagent for methodological studies in organic chemistry and medicinal chemistry programs.
• Bioconjugation Chemistry: The carboxylic acid group provides a handle for coupling to biomolecules like peptides or proteins for probe development.

Basic Information

Item	Detail
Product Name	4-Isoxazolecarboxylic Acid, 3-Phenyl-5-[[(Phenylmethyl)Amino]Methyl]-
CAS No.	682352-97-2
Molecular Formula	C18H16N2O3
Molecular Weight	308.33 g/mol
Synonyms	3-Phenyl-5-[(benzylamino)methyl]isoxazole-4-carboxylic acid; 5-[(Benzylamino)methyl]-3-phenyl-4-isoxazolecarboxylic acid; 682352-97-2; 4-Isoxazolecarboxylic acid, 3-phenyl-5-[(phenylmethyl)amino]methyl]-; 3-Phenyl-5-(benzylaminomethyl)isoxazole-4-carboxylic acid
EINECS	Contact for details

Quality Control

Every batch of 4-Isoxazolecarboxylic Acid, 3-Phenyl-5-[[(Phenylmethyl)Amino]Methyl]- is produced under strict quality management protocols. We employ advanced analytical techniques including HPLC, NMR, and mass spectrometry to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing all specification parameters is provided with each shipment, ensuring full traceability and compliance with your research or production requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). This compound may be hygroscopic (moisture-sensitive); therefore, the container should be kept tightly sealed under an inert atmosphere if specified. Keep away from strong oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Loss on Drying	≤ 1.0%
Residue on Ignition	≤ 0.5%
Heavy Metals	≤ 20 ppm

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