1228570-37-3

Basic information

• Product Name: (S)-2-(2-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE
• Synonyms: (S)-2-(2-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE;(2S)-2-[2-(TRIFLUOROMETHYL)PHENYL]PIPERIDINE
• CAS NO: 1228570-37-3
• Molecular Formula: C12H14F3N
• Molecular Weight: 229.24
• Mol File: 1228570-37-3.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 267.0±40.0 °C(Predicted)
• Appearance: /
• Density: 1.145±0.06 g/cm3(Predicted)
• PKA: 9.35±0.10(Predicted)
• CAS DataBase Reference: (S)-2-(2-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-2-(2-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE(1228570-37-3)
• EPA Substance Registry System: (S)-2-(2-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE(1228570-37-3)

Safety Data

• Hazardous Substances Data: 1228570-37-3(Hazardous Substances Data)

Usage

General Description

(S)-2-(2-(trifluoromethyl)phenyl)piperidine is a chemical compound with the molecular formula C13H15F3N. It is a piperidine derivative with a trifluoromethyl group attached to a phenyl ring. (S)-2-(2-(TRIFLUOROMETHYL)PHENYL)PIPERIDINE is commonly used as a building block in the synthesis of various pharmaceuticals and agrochemicals. It is also used in research as a potential ligand for various biological targets, particularly in the development of new drug candidates. Its unique structure and properties make it an important intermediate in the production of diverse compounds for pharmaceutical and research purposes.

Relevant articles and documents

Using the competing enantioselective conversion method to assign the absolute configuration of cyclic amines with BODE’s acylation reagents

The competing enantioselective conversion (CEC) method is a quick and reliable means to determine absolute configuration. Previously, Bode’s chiral acylated hydroxamic acids were used to determine the stereochemistry of primary amines, as well as cyclic and acyclic secondary amines. The enantioselective acylation has been evaluated for 4-, 5-, and 6-membered cyclic secondary amines, including medicinally relevant compounds. The limitations of the method were studied through computational analysis and experimental results. Piperidines with substituents at the 2-position did not behave well unless the axial conformer was energetically accessible, which is consistent with the transition state geometries proposed by Bode and Kozlowski. Control experiments were performed to investigate the cause of degrading selectivity under the CEC reaction conditions. The present study expands the scope of the CEC method for secondary amines and provides a better understanding of the reaction profile.