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2,2,2-Trifluoro-1-(2-hydroxy-5-methylphenyl)-ethanone is an organic compound with the molecular formula C10H9F3O2. It features a ketone functional group and is distinguished by the presence of three fluorine atoms and a hydroxyl group attached to a benzene ring. This unique structure and reactivity make it a valuable intermediate in the synthesis of various organic compounds.

70978-57-3

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70978-57-3 Usage

Uses

Used in Pharmaceutical Industry:
2,2,2-Trifluoro-1-(2-hydroxy-5-methylphenyl)-ethanone is used as an intermediate in the synthesis of pharmaceuticals for its unique structure and reactivity, contributing to the development of new drugs and therapeutic agents.
Used in Agrochemical Industry:
In the agrochemical industry, 2,2,2-trifluoro-1-(2-hydroxy-5-methylphenyl)-ethanone serves as an intermediate in the synthesis of agrochemicals, playing a role in the creation of pesticides, herbicides, and other agricultural products.
Used in Research and Development:
2,2,2-Trifluoro-1-(2-hydroxy-5-methylphenyl)-ethanone is utilized in research and development processes across the pharmaceutical and agrochemical industries due to its distinctive fluorinated structure, which aids in the study of chemical and biological processes.

Check Digit Verification of cas no

The CAS Registry Mumber 70978-57-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,0,9,7 and 8 respectively; the second part has 2 digits, 5 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 70978-57:
(7*7)+(6*0)+(5*9)+(4*7)+(3*8)+(2*5)+(1*7)=163
163 % 10 = 3
So 70978-57-3 is a valid CAS Registry Number.
InChI:InChI=1/C9H7F3O2/c1-5-2-3-7(13)6(4-5)8(14)9(10,11)12/h2-4,13H,1H3

70978-57-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,2,2-trifluoro-1-(2-hydroxy-5-methylphenyl)ethanone

1.2 Other means of identification

Product number -
Other names o-trifluoroacetyl-p-cresol

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:70978-57-3 SDS

70978-57-3Relevant academic research and scientific papers

Enantioselective (3+2) cycloaddition: Via N-heterocyclic carbene-catalyzed addition of homoenolates to cyclic N -sulfonyl trifluoromethylated ketimines: Synthesis of fused N-heterocycle γ-lactams

Zhang, Zhen-Zhen,Zhang, Yongna,Duan, Hui-Xin,Deng, Zhuo-Fei,Wang, You-Qing

, p. 1553 - 1556 (2020/02/13)

An enantioselective (3+2) cycloaddition of enals and cyclic N-sulfonyl trifluoromethyl ketimines via N-heterocyclic carbene-catalyzed homoenolate addition is described. This reaction can efficiently construct fused N-heterocycle γ-lactams bearing two adjacent chiral centers with >20?:?1 dr and 94-99% ee, with one chiral center as a trifluoromethylated α-tetrasubstituted carbon stereocenter.

Isoxazoline derivative and applications in agriculture

-

Paragraph 0164-0166, (2019/07/04)

The present invention provides an isoxazoline derivative and applications in agriculture, and particularly relates to a new isoxazoline derivative and a preparation method thereof, and a composition containing the compound, and applications in agriculture, particularly as the herbicide active ingredient in prevention and control of unwanted plants.

Highly Enantioselective Construction of Fluoroalkylated Quaternary Stereocenters via Organocatalytic Dehydrated Mannich Reaction of Unprotected Hemiaminals with Ketones

Zhang, Sheng,Li, Lijun,Hu, Yanbin,Li, Yanan,Yang, Yu,Zha, Zhenggen,Wang, Zhiyong

supporting information, p. 5036 - 5039 (2015/11/03)

A general organocatalytic asymmetric dehydrated Mannich reaction of fluoroalkyl hemiaminals with ketones is reported. In this Mannich reaction, previously less explored aryl ketones showed great reactivity. By virtue of this efficient method, a wide range of biologically active β-amino ketones were directly obtained. More importantly, two different intermediates involved in the reaction were detected and identified by 19F NMR and HRMS analysis. Furthermore, the synthetic utility of the products was demonstrated by the synthesis of the biologically active fluoroalkyl β-amino alcohols.

Halogenation of fluorinated cyclic 1,3-dicarbonyl compounds: new aspects of synthetic application

Sevenard, Dmitri V.,Vorobyev, Mikhail,Sosnovskikh, Vyacheslav Ya.,Wessel, Helma,Kazakova, Olesya,Vogel, Vera,Shevchenko, Nikolay E.,Nenajdenko, Valentine G.,Lork, Enno,R?schenthaler, Gerd-Volker

, p. 7538 - 7552 (2009/12/06)

In order to elaborate on an approach towards 2-(fluoroacyl)phenols being the superior alternative to the conventional Fries-rearrangement based methodology, the behaviour of cyclic fluorinated 1,3-dicarbonyls in reactions with halogenating agents was examined. The synthetic relevance of the polyhalogenated compounds obtained was demonstrated by the synthesis of several new heterocycles. An aromatization via a halogenation-dehydrohalogenation sequence proved to be a rewarding synthetic route to 2-(fluoroacyl)phenols and previously unknown 3-(fluoroacyl)thiochromones. The structure of one of the synthesized compounds was confirmed by X-ray diffraction analysis.

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