Description

tert-Butyl4-(3-Phenylpropyl)-1,4-Diazepane-1-Carboxylate is a high-purity, protected diazepane derivative of significant interest in advanced organic synthesis. This compound serves as a crucial pharmaceutical intermediate and building block for the development of novel active pharmaceutical ingredients (APIs) and fine chemicals. It is primarily utilized by research institutions and chemical manufacturers in the pharmaceutical, agrochemical, and specialty chemical sectors for process development and scale-up activities.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of complex molecules with potential therapeutic applications, particularly in central nervous system (CNS) and other drug discovery programs.
• Organic Synthesis Building Block: Used for constructing complex heterocyclic frameworks and introducing the 1,4-diazepane moiety into target molecules.
• Medicinal Chemistry Research: Employed in lead optimization and structure-activity relationship (SAR) studies to develop new chemical entities.
• Agrochemical Synthesis: Serves as an intermediate in the development of novel pesticides and herbicides.
• Catalyst and Ligand Development: Potential use in the creation of novel chiral ligands or organocatalysts for asymmetric synthesis.
• Custom Synthesis Projects: A starting material for contract research and manufacturing organizations (CROs/CMOs) producing bespoke compounds for clients.

Basic Information

Product Name	tert-Butyl4-(3-Phenylpropyl)-1,4-Diazepane-1-Carboxylate
CAS No.	198895-74-8
Molecular Formula	C19H30N2O2
Molecular Weight	318.46 g/mol
Synonyms	1,4-Diazepane-1-carboxylic acid, 4-(3-phenylpropyl)-, 1,1-dimethylethyl ester; 1-Boc-4-(3-phenylpropyl)-1,4-diazepane; tert-Butyl 4-(3-phenylpropyl)-1,4-diazepane-1-carboxylate; Boc-1,4-diazepane derivative; 4-(3-Phenylpropyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester
EINECS	Contact for details

Quality Control

Our tert-Butyl4-(3-Phenylpropyl)-1,4-Diazepane-1-Carboxylate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC, NMR, and MS, to ensure high purity and consistent identity. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all relevant specifications. Our quality commitment aligns with the standards expected for GMP intermediates and research chemicals.

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 must be kept under an inert atmosphere (e.g., nitrogen or argon) in a desiccator for long-term storage to prevent degradation. Keep away from heat and incompatible materials.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
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.