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4-(4-Trifluoromethylphenyl)pyridine, with the chemical formula C12H8F3N, is a pyridine derivative that belongs to the class of heterocyclic aromatic compounds. It features a six-membered ring composed of five carbon atoms and one nitrogen atom, with a 4-(4-trifluoromethylphenyl) group attached to the pyridine ring. This substitution endows the molecule with distinctive chemical and physical characteristics, making it a valuable component in various chemical applications.

220000-88-4

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220000-88-4 Usage

Uses

Used in Pharmaceutical Synthesis:
4-(4-Trifluoromethylphenyl)pyridine serves as a key building block in the creation of a range of pharmaceuticals. Its unique structure and properties allow it to be incorporated into the development of new drugs, potentially leading to the discovery of novel therapeutic agents.
Used in Agrochemical Development:
In the agrochemical industry, 4-(4-Trifluoromethylphenyl)pyridine is utilized as a fundamental component in the synthesis of various agrochemicals. Its incorporation can enhance the effectiveness of these products, contributing to advancements in crop protection and management.
Used in Organic Compounds Synthesis:
This versatile compound is also employed in the synthesis of other organic compounds, broadening its applications across different sectors of the chemical industry.
Used in Materials Science:
Due to its structural and electronic properties, 4-(4-Trifluoromethylphenyl)pyridine holds potential in materials science, where it can be explored for its possible role in creating new materials with specific properties for various applications.
Used in Chemical Research:
4-(4-TRIFLUOROMETHYLPHENYL)PYRIDINE's unique characteristics make it a valuable subject for chemical research, where it can be studied to understand its reactivity, stability, and potential interactions with other molecules, thereby contributing to the advancement of chemical knowledge.

Check Digit Verification of cas no

The CAS Registry Mumber 220000-88-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,2,0,0,0 and 0 respectively; the second part has 2 digits, 8 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 220000-88:
(8*2)+(7*2)+(6*0)+(5*0)+(4*0)+(3*0)+(2*8)+(1*8)=54
54 % 10 = 4
So 220000-88-4 is a valid CAS Registry Number.
InChI:InChI=1/C12H8F3N/c13-12(14,15)11-3-1-9(2-4-11)10-5-7-16-8-6-10/h1-8H

220000-88-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(4-(Trifluoromethyl)phenyl)pyridine

1.2 Other means of identification

Product number -
Other names 4-[4-(trifluoromethyl)phenyl]pyridine

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:220000-88-4 SDS

220000-88-4Relevant academic research and scientific papers

Tunable Second-Level Room-Temperature Phosphorescence of Solid Supramolecules between Acrylamide–Phenylpyridium Copolymers and Cucurbit[7]uril

Xu, Wen-Wen,Chen, Yong,Lu, Yi-Lin,Qin, Yue-Xiu,Zhang, Hui,Xu, Xiufang,Liu, Yu

supporting information, (2021/12/24)

A series of solid supramolecules based on acrylamide–phenylpyridium copolymers with various substituent groups (P?R: R=?CN, ?CO2Et, ?Me, ?CF3) and cucurbit[7]uril (CB[7]) are constructed to exhibit tunable second-level (from 0.9 s to

Organocatalytic synthesis of (Het)biaryl scaffoldsviaphotoinduced intra/intermolecular C(sp2)-H arylation by 2-pyridone derivatives

Das, Tapas Kumar,Kundu, Mrinalkanti,Mondal, Biswajit,Ghosh, Prasanjit,Das, Sajal

, p. 208 - 218 (2021/12/29)

A uniqueN,O-bidentate ligand 6-oxo-1,6-dihydro-pyridone-2-carboxylic acid dimethylamide (L1) catalyzed direct C(sp2)-H (intra/intermolecular) arylation of unactivated arenes has been developed to expedite access to (Het)biaryl scaffolds under UV-irradiation at room temperature. The protocol tolerated diverse functional groups and substitution patterns, affording the target products in moderate to excellent yields. Mechanistic investigations were also carried out to better understand the reaction pathway. Furthermore, the synthetic applicability of this unified approach has been showcasedviathe construction of biologically relevant 4-quinolone, tricyclic lactam and sultam derivatives.

Palladium-Catalyzed Electrophilic Functionalization of Pyridine Derivatives through Phosphonium Salts

Che, Yuan-Yuan,Deng, Xuezu,Feng, Chao,Lin, Ling-Zhi,Pei, Bingbing,Yue, Yanni

supporting information, p. 16414 - 16419 (2020/07/20)

Herein, we report a highly efficient and practical method for pyridine-derived heterobiaryl synthesis through palladium-catalyzed electrophilic functionalization of easily available pyridine-derived quaternary phosphonium salts. The nice generality of this reaction was goes beyond arylation, enabling facile incorporation of diverse carbon-based fragments, including alkenyl, alkynyl, and also allyl fragments, onto the pyridine core. Notably, the silver salt additive is revealed to be of vital importance for the success of this transformation and its pivotal role as transmetallation mediator, which guarantees a smooth transfer of pyridyl group to palladium intermediate, is also described.

Pyridine sulfinates as general nucleophilic coupling partners in palladium-catalyzed cross-coupling reactions with aryl halides

Markovic, Tim,Rocke, Benjamin N.,Blakemore, David C.,Mascitti, Vincent,Willis, Michael C.

, p. 4437 - 4442 (2017/07/11)

Pyridine rings are ubiquitous in drug molecules; however, the pre-eminent reaction used to form carbon-carbon bonds in the pharmaceutical industry, the Suzuki-Miyaura cross-coupling reaction, often fails when applied to these structures. This phenomenon is most pronounced in 2-substituted pyridines, and results from the difficulty in preparing, the poor stability of, and low efficiency in reactions of pyridine-2-boronates. We demonstrate that by replacing these boronates with pyridine-2-sulfinates, a cross-coupling process of unrivalled scope and utility is realized. The corresponding 3-And 4-substituted pyridine variants are also efficient coupling partners. In addition, we apply these sulfinates in a library format to the preparation of medicinally relevant derivatives of the drugs varenicline (Chantix) and mepyramine (Anthisan).

Phosphonium Salts as Pseudohalides: Regioselective Nickel-Catalyzed Cross-Coupling of Complex Pyridines and Diazines

Zhang, Xuan,McNally, Andrew

, p. 9833 - 9836 (2017/08/08)

Heterobiaryls are important pharmacophores that are challenging to prepare by traditional cross-coupling methods. An alternative approach is presented where pyridines and diazines are converted into heteroaryl phosphonium salts and coupled with aryl boronic acids. Nickel catalysts are unique for selective heteroaryl transfer, and the reaction has a broad substrate scope that includes complex pharmaceuticals. Phosphonium ions also display orthogonal reactivity in cross-couplings compared to halides, enabling chemoselective palladium- and nickel-catalyzed coupling sequences.

Silver-catalyzed arylation of (hetero)arenes by oxidative decarboxylation of aromatic carboxylic acids

Kan, Jian,Huang, Shijun,Lin, Jin,Zhang, Min,Su, Weiping

supporting information, p. 2199 - 2203 (2015/02/19)

A long-standing challenge in Minisci reactions is achieving the arylation of heteroarenes by oxidative decarboxylation of aromatic carboxylic acids. To address this challenge, the silver-catalyzed intermolecular Minisci reaction of aromatic carboxylic acids was developed. With an inexpensive silver salt as a catalyst, this new reaction enables a variety of aromatic carboxylic acids to undergo decarboxylative coupling with electron-deficient arenes or heteroarenes regardless of the position of the substituents on the aromatic carboxylic acid, thus eliminating the need for ortho-substituted aromatic carboxylic acids, which were a limitation of previously reported methods.

Palladium dichloride adduct of N,N-bis-(diphenylphosphanylmethyl)-2- aminopyridine: Synthesis, structure and catalytic performance in the decarboxylative cross-coupling of 4-picolinic acid with aryl bromide

He, Run-Tian,Wang, Jian-Feng,Wang, Hui-Fang,Ren, Zhi-Gang,Lang, Jian-Ping

, p. 9786 - 9794 (2014/06/23)

Reaction of PdCl2 with N,N-bis-(diphenylphosphanylmethyl)-2- aminopyridine (bdppmapy) afforded a mononuclear complex [(bdppmapy)PdCl 2] (1). Compound 1 was characterized by elemental analysis, IR, 1H, 13C and 31P NMR, electrospray ion mass spectra (ESI-MS) and X-ray single crystal crystallography. The Pd(ii) center in 1 is chelated by bdppmapy, showing a cis-square planar geometry. With the assistance of additive Cu2O, complex 1 exhibited good catalytic activity toward the decarboxylative cross-coupling reactions between 4-picolinic acid and aryl bromides. In the presence of only 2 mol% catalyst, a family of 4-aryl-pyridines could be isolated in up to 83% yield.

Metal-free arylation of benzene and pyridine promoted by amino-linked nitrogen heterocyclic carbenes

Chen, Wen-Ching,Hsu, Yu-Chen,Shih, Wei-Chun,Lee, Ching-Yu,Chuang, Wen-Han,Tsai, Yi-Fang,Chen, Peter Ping-Yu,Ong, Tiow-Gan

supporting information; experimental part, p. 6702 - 6704 (2012/07/14)

An amino-linked nitrogen heterocyclic carbene (amino-NHC), 1-tBu, has been shown to mediate carbon-carbon coupling through the direct C-H functionalization of benzene and pyridine in the absence of a metal catalyst. Using EPR, the first spectroscopic evidence corroborating the single electron transfer mechanism for the metal-free carbon-carbon coupling manifold, as reported by others, is introduced.

HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK

-

, (2011/04/14)

Disclosed herein are new heterocyclic compounds and compositions and their application as pharmaceuticals for the treatment of disease. Methods of inhibiting PAS Kinase (PASK) activity in a human or animal subject are also provided for the treatment of diseases such as diabetes mellitus.

Vesicular monoamine transporter substrate/inhibitor activity of MPTP/MPP+ derivatives: A structure-activity study

Wimalasena, D. Shyamali,Perera, Rohan P.,Heyen, Bruce J.,Balasooriya, Inoka S.,Wimalasena, Kandatege

, p. 760 - 768 (2008/09/19)

The active metabolite of 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (MPTP), N-methyl-4-phenylpyridinium (MPP+), selectively destroys the dopaminergic neurons and induces the symptoms of Parkinson's disease. Inhibition of mitochondrial complex

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