Description

n-[2-(Hexahydro-1H-Azepin-1-Yl)Ethyl]Phenylethylmalonamidic Acid Ethyl Ester CAS NO 96064-46-9 is a specialized organic compound featuring a malonamidic acid ester core integrated with a phenylethyl and a substituted azepine moiety. This unique molecular architecture makes it a valuable chemical intermediate for the synthesis of more complex pharmacologically active molecules. It is primarily sought by pharmaceutical research and development organizations and fine chemical manufacturers engaged in advanced organic synthesis.

Application

• Pharmaceutical Intermediate: Serves as a key building block in the research and synthesis of novel active pharmaceutical ingredients (APIs), particularly those targeting neurological or receptor-based pathways.
• Medicinal Chemistry Research: Used in the design and development of new drug candidates, leveraging its complex heterocyclic and amide functionalities for structure-activity relationship (SAR) studies.
• Fine Chemical Synthesis: Employed in multi-step organic synthesis to construct complex molecular frameworks for specialty chemicals and advanced materials.
• Biochemical Research: Potential use as a precursor or ligand in the development of biochemical probes and enzyme inhibitors for research purposes.

Basic Information

Product Name	n-[2-(Hexahydro-1H-Azepin-1-Yl)Ethyl]Phenylethylmalonamidic Acid Ethyl Ester
CAS No.	96064-46-9
Molecular Formula	C23H34N2O3
Molecular Weight	386.53 g/mol
Synonyms	Ethyl 2-[2-(azepan-1-yl)ethyl]-2-(2-phenylethyl)malonamate; 2-[2-(Hexahydro-1H-azepin-1-yl)ethyl]-2-(2-phenylethyl)propanedioic Acid 1-Ethyl Ester; Phenylethylmalonamidic Acid Ethyl Ester, N-[2-(Hexahydro-1H-Azepin-1-yl)ethyl]-; 96064-46-9; UNII-3U3F6D8W4I; 3U3F6D8W4I; Azepine derivative intermediate
EINECS	Contact for details

Quality Control

Our n-[2-(Hexahydro-1H-Azepin-1-Yl)Ethyl]Phenylethylmalonamidic Acid Ethyl Ester is produced under a strict quality management system. Every batch undergoes rigorous analytical testing to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing key specifications such as assay and impurity profiles. Our quality commitment supports compliance with cGMP standards for pharmaceutical intermediates.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (15-25°C). Keep away from incompatible materials such as strong oxidizing agents. For long-term storage, consider an inert atmosphere to preserve stability.

Specification

Item	Specification
Appearance	White to off-white powder or crystalline solid
Identification (IR)	Conforms to reference spectrum
Assay (HPLC)	≥ 97.0%
Related Substances (HPLC)	Total impurities ≤ 3.0%
Any single unknown impurity	≤ 1.0%
Loss on Drying	≤ 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.