Description

3-Isoxazolecarboxylicacid,4-(Hydroxymethyl)-5-(3-Iodophenyl)-,Ethylester(9Ci) is a specialized heterocyclic building block of significant interest in advanced organic synthesis. This compound matters for its unique molecular architecture, which combines an isoxazole core with iodophenyl and hydroxymethyl functionalities, making it a versatile precursor for constructing complex pharmacophores. It is primarily needed by research and development teams in the pharmaceutical and agrochemical industries for the discovery and development of new active ingredients.

Application

• Pharmaceutical Intermediate: Serves as a critical building block in the synthesis of novel drug candidates, particularly for targeting central nervous system (CNS) disorders and other therapeutic areas.
• Agrochemical Research: Used in the development of new pesticides and herbicides, leveraging its heterocyclic structure for bioactivity.
• Chemical Biology Probe: Acts as a scaffold or labeling agent in the study of biological pathways and protein interactions due to its reactive sites.
• Material Science Precursor: Potential use in the synthesis of advanced organic materials, such as ligands for catalysts or components in organic electronics.
• Custom Synthesis & Contract Manufacturing: Supplied to CDMOs (Contract Development and Manufacturing Organizations) for client-specific synthesis projects requiring complex heterocycles.

Basic Information

Product Name	3-Isoxazolecarboxylicacid,4-(Hydroxymethyl)-5-(3-Iodophenyl)-,Ethylester(9Ci)
CAS No.	745079-24-7
Molecular Formula	C13H12INO4
Molecular Weight	373.15 g/mol
Synonyms	Ethyl 4-(hydroxymethyl)-5-(3-iodophenyl)isoxazole-3-carboxylate; 4-(Hydroxymethyl)-5-(3-iodophenyl)isoxazole-3-carboxylic Acid Ethyl Ester; 5-(3-Iodophenyl)-4-(hydroxymethyl)isoxazole-3-carboxylic Acid Ethyl Ester; 745079-24-7; AI3-73710; SCHEMBL2188491; ZINC000095049793; Ethyl 5-(3-iodophenyl)-4-(hydroxymethyl)-1,2-oxazole-3-carboxylate
EINECS	Contact for details

Quality Control

Our 3-Isoxazolecarboxylicacid,4-(Hydroxymethyl)-5-(3-Iodophenyl)-,Ethylester(9Ci) is produced under a strict quality management system. Each batch undergoes rigorous analytical testing, including HPLC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing all specifications is provided with every shipment to support your R&D and regulatory needs.

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). Keep away from heat and incompatible materials. For long-term storage, consider inert atmosphere conditions to ensure optimal stability.

Specification

Item	Specification
Appearance	White to off-white powder or crystalline solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 95% (Standard Grade)
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

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