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2-(4-Fluorophenyl)benzoxazole is an organic compound with the molecular formula C13H8FNO and a molecular weight of 213.21 g/mol. It is a derivative of benzoxazole, featuring a benzene ring fused to an oxazole ring, with a 4-fluorophenyl group attached to the 2-position of the benzoxazole. 2-(4-Fluorophenyl)benzoxazole is characterized by its unique electronic properties due to the presence of the fluorine atom, which can influence its reactivity and stability. It is often used in the synthesis of pharmaceuticals and other organic compounds, particularly in the development of new materials with specific electronic or optical properties. The compound's structure and properties make it a valuable intermediate in the creation of various chemical entities, highlighting its importance in the field of organic chemistry.

397-54-6

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397-54-6 Usage

Type of compound

Benzoxazole derivative

Contains

Fluorophenyl group

Field of use

Organic chemistry

Application 1

Fluorescent dye for biological imaging

Application 2

Precursor in the synthesis of novel materials

Pharmaceutical potential

Antitumor agent

Pharmaceutical potential

Probe for detecting specific cellular components

Useful for

Research and industrial applications

Key property

Fluorescent properties

Check Digit Verification of cas no

The CAS Registry Mumber 397-54-6 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 3,9 and 7 respectively; the second part has 2 digits, 5 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 397-54:
(5*3)+(4*9)+(3*7)+(2*5)+(1*4)=86
86 % 10 = 6
So 397-54-6 is a valid CAS Registry Number.

397-54-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(4-Fluorophenyl)-1,3-benzoxazole

1.2 Other means of identification

Product number -
Other names -

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:397-54-6 SDS

397-54-6Relevant academic research and scientific papers

Novel carbazole-based multifunctional materials with a hybridized local and charge-transfer excited state acting as deep-blue emitters and phosphorescent hosts for highly efficient organic light-emitting diodes

Gao, Zhixiang,Huang, Jinhai,Jin, Xin,Miao, Yanqin,Su, Jianhua,Tian, He,Wang, Hua,Yin, Mengna,Zhao, Zhenhong,Zhou, Haitao

, p. 5899 - 5907 (2021)

In this work, two carbazole- and benzo[d]oxazole-based novel multifunctional materials with a hybridized local and charge-transfer (HLCT) characteristic, namely,OCIandOCT, which could act as deep-blue fluorophors and phosphorescent hosts, were first desig

Dowex 50W: A green mild reusable catalyst for the synthesis of 2-aryl benzoxazole derivatives in aqueous medium

Datta, Arup

, p. 341 - 347 (2021/05/19)

In this work simple efficient, one pot and environmentally friendly method was developed for the synthesis of 2-Aryl-1H-benzoxazole derivatives at 80oC using ortho-aminophenol and various aldehydes. It has been found that Dowex 50W is an effective catalyst to prepare moderate to high yield of a variety of benzoxazole derivatives through a clean and simple process. Aqueous medium, green methodology, rapid reaction, reusability of heterogeneous catalyst are the great advantages of this protocol.

Organic electrophosphorescent host material and application thereof in organic electroluminescent device

-

Paragraph 0042-0045, (2021/05/12)

The invention relates to the technical field of organic electroluminescent devices, in particular to an organic electroluminescent material and application thereof in an organic electroluminescent device. The organic electroluminescent material has good p

Carbazole-based organic electroluminescent material and application thereof in devices

-

Paragraph 0049-0052, (2021/05/29)

The invention relates to the technical field of organic electroluminescent devices, in particular to a carbazole-based organic electroluminescent material and application thereof in an organic electroluminescent device. The organic electroluminescent mate

Delivering 2-Aryl Benzoxazoles through Metal-Free and Redox-Neutral De-CF3Process

Qiao, Xinxin,Zhao, Yong-De,Rao, Mingru,Bu, Zhan-Wei,Zhang, Guangwu,Xiong, Heng-Ying

, p. 13548 - 13558 (2021/10/01)

An unexpected cleavage of the Csp3-CF3 bond of CF3-hydrobenzoxazoles has been disclosed, affording a range of 2-aryl benzoxazoles under metal-free and redox-neutral conditions. This transformation has demonstrated broad substrate scope and good compatibility of functional groups. 2-Aryl benzothiazole and 2-aryl benzoimidazole could be smoothly assembled in the same manner. On the basis of preliminary mechanistic studies, base initiated and aromatization driven β-carbon elimination was considered to be the key step for the formation of 2. This reaction offers an alternative, facile, and sustainable route to access important 2-aryl benzoxazole motifs.

TEMPO-mediated aerobic oxidative synthesis of 2-aryl benzoxazoles via ring-opening of benzoxazoles with benzylamines

Rao, Mugada Sugunakara,Hussain, Sahid

, p. 2684 - 2694 (2021/07/26)

A simple and efficient TEMPO-mediated system for aerobic oxidative synthesis of 2-aryl benzoxazoles from readily available benzoxazoles and primary benzylic and hetero benzylic amines is presented in one pot. The reaction proceeds through the ring-opening of benzoxazoles and is followed by oxidative condensation with benzylamines. These metal-free, straightforward reactions worked well with a wide range of substrates, yielding moderate to good yields under mild conditions using air as an external green oxidant.

Stable Pd(0) Complexes with Ferrocene Bisphosphanes Bearing Phosphatrioxaadamantyl Substituents Efficiently Catalyze Selective C-H Arylation of Benzoxazoles by Aryl Chlorides

Horky, Filip,Císa?ová, Ivana,?těpni?ka, Petr

, p. 4848 - 4856 (2021/10/12)

Versatile applications and unique performance of 1,1’-bis(diphenylphosphanyl)ferrocene (dppf) in coordination chemistry and catalysis prompted the search for its analogs. This contribution describes the synthesis of the first donor-unsymmetric dppf congeners bearing bulky and rigid 1,3,5,7-tetramethyl-2,4,6-trioxa-8-phosphaadamantyl (CgP) donor groups, viz. Ph2PfcPCg (1) and Ph2PfcCH2PCg (2; fc=ferrocene-1,1’-diyl). Bis-phosphanes 1 and 2 were converted into air-stable Pd(0) complexes, [Pd(ma)(L^L)] (L^L=1 and 2; ma=maleic anhydride). Together with [Pd(ma)(dppf)], these complexes were applied as catalysts in Pd-catalyzed C?H arylation of benzoxazoles with aryl chlorides in n-butanol as an environmentally benign solvent. Among all catalysts tested in this study, complex [Pd(ma)(2)] performed the best, providing a high-yield and selective synthesis of 2-arylbenzoxazoles from a range of the generally less reactive chloroarenes at low catalyst loading (typically 1 mol.%). Under similar conditions, the structurally related heterocycles (e. g., 1-methylbenzimidazole and benzothiazole) did not react.

Heterocyclic reaction inducted by Br?nsted–Lewis dual acidic Hf-MOF under microwave irradiation

Nguyen, Linh Ho Thuy,Nguyen, Trang Thi Thu,Dang, Minh-Huy Dinh,Tran, Phuong Hoang,Doan, Tan Le Hoang

, (2020/11/24)

Use of green chemistry and alternative strategies has been explored to prepare diverse organic derivatives. The combination between heterogeneous catalyst, environmentally benign reaction and high-yielding methods is gaining momentum. Herein, a defective 6-connected Hf-MOF, named Hf-BTC, was efficiently synthesized and characterized for the heterogeneous catalysis under microwave irradiation. The MOF features including structural defect, porosity, acidity, and stability was analyzed by powder X-ray diffraction, N2 sorption isotherms, acid-base titration, and thermal gravimetric analysis. In the catalytic studies, the Br?nsted-Lewis dual acidic Hf-BTC was efficiently applied for the synthesis of the heterocyclic compounds via the microwave-assisted cycloaddition and condensation reactions. The reactions proceeded smoothly in the presence of the Hf-MOF with a broad scope of substrates provided the expected products in high to excellent yields (up to 99 %) for few minutes and the catalyst could be easily recycle over many consecutive reactions without loss of its reactivity and structure.

Efficient Cu-catalyzed intramolecular: O -arylation for synthesis of benzoxazoles in water

Gao, Hui,Li, Minxin,Mao, Zewei,Rao, Gaoxiong,Tang, Yanling

, p. 14317 - 14321 (2020/04/23)

An efficient method was developed for synthesis of benzoxazoles by Cu-catalyzed intramolecular O-arylation of o-halobenzanilides in water. This strategy provides several advantages, such as high yields, water as a green solvent and functional groups tolerance.

Diamine monomer containing benzoxazole and carbazole structures, and preparation method and application thereof

-

Paragraph 0063-0067, (2020/06/02)

The invention discloses a diamine monomer containing benzoxazole and carbazole structures, and a preparation method and an application thereof. Starting from dihalogenated carbazole, active hydrogen in monomer carbazole is grafted with a structural unit c

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