4-[(4-Bromophenyl)amino]piperidine-1-carboxylic acid tert-butyl ester
[CAS# 443998-65-0]

Identification

• Classification: Organic raw materials >> Heterocyclic compound >> Piperidines
• Name: 4-[(4-Bromophenyl)amino]piperidine-1-carboxylic acid tert-butyl ester
• Molecular Formula: C₁₆H₂₃BrN₂O₂
• Molecular Weight: 355.27
• CAS Registry Number: 443998-65-0
• EC Number: 965-400-8
• SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC2=CC=C(C=C2)Br

Properties

• Solubility: Practically insoluble (0.039 g/L) (25 ºC), Calc.^*
• Density: 1.336±0.06 g/cm³ (20 ºC 760 Torr), Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2014 ACD/Labs)

Safety Data

• Hazard Symbols: GHS07 Warning
• Hazard Statements: H302-H315-H319-H335
• Precautionary Statements: P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Specific target organ toxicity - single exposure	STOT SE	3	H335
Skin irritation	Skin Irrit.	2	H315
Eye irritation	Eye Irrit.	2A	H319
Acute toxicity	Acute Tox.	4	H302

Discovory and Applicatios

4-[(4-Bromophenyl)amino]piperidine-1-carboxylic acid tert-butyl ester, often abbreviated as BOC-4-APBA, was discovered through meticulous chemical synthesis and screening processes. This compound, a piperidine derivative, features a tert-butyl ester group attached to a piperidine ring, with a bromophenylamino moiety. Its synthesis involved intricate steps of organic chemistry, culminating in the creation of a versatile molecule with promising properties for various applications.

BOC-4-APBA serves as a valuable tool in chemical biology research, particularly in the study of cellular processes and drug interactions. Its unique structure allows researchers to probe specific molecular interactions within biological systems, aiding in the development of novel therapeutics and understanding disease mechanisms.

The compound's structural features make it a promising candidate for medicinal chemistry applications. Researchers are exploring its potential as a scaffold for designing new drugs, especially in the treatment of neurological disorders and cancer. By modifying its chemical structure, scientists can tailor its properties to target specific biological pathways, enhancing therapeutic efficacy and reducing side effects.

BOC-4-APBA exhibits affinity towards certain receptors in the nervous system, making it valuable in neuroscience research. It can be utilized to investigate neuronal signaling pathways, synaptic transmission, and receptor modulation. Understanding these processes is crucial for developing treatments for neurological conditions such as Alzheimer's disease, Parkinson's disease, and schizophrenia.

The unique properties of BOC-4-APBA make it suitable for constructing chemical sensors for detecting various analytes. By incorporating it into sensor platforms, researchers can develop sensitive and selective detection systems for environmental monitoring, medical diagnostics, and food safety applications. Its versatility allows for the detection of a wide range of substances with high accuracy and precision.

BOC-4-APBA has potential applications in materials science, particularly in the fabrication of functional materials and polymers. Its chemical reactivity and compatibility with other compounds make it useful for synthesizing advanced materials with tailored properties. These materials can find applications in fields such as electronics, photonics, and catalysis, contributing to the development of next-generation technologies.