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Benzoic acid, 2-[[3-(trifluoromethyl)phenyl]amino]-, ethyl ester, also known as ethyl 2-[3-(trifluoromethyl)anilino]benzoate, is a chemical compound with the molecular formula C11H10F3NO2. It is an ester derivative of benzoic acid, featuring a trifluoromethylphenylamine group attached to the benzene ring. Benzoic acid, 2-[[3-(trifluoromethyl)phenyl]amino]-, ethyl ester is often used as an intermediate in the synthesis of pharmaceuticals and agrochemicals due to its unique properties, such as its potential to act as a precursor for the development of new drugs with improved efficacy and reduced side effects. The presence of the trifluoromethyl group enhances the lipophilicity and metabolic stability of the molecule, which can be crucial for its biological activity.

2766-16-7

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2766-16-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 2766-16-7 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,7,6 and 6 respectively; the second part has 2 digits, 1 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 2766-16:
(6*2)+(5*7)+(4*6)+(3*6)+(2*1)+(1*6)=97
97 % 10 = 7
So 2766-16-7 is a valid CAS Registry Number.

2766-16-7SDS

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 ethyl 2-[3-(trifluoromethyl)anilino]benzoate

1.2 Other means of identification

Product number -
Other names N-(3-Trifluormethyl-phenyl)-anthranilsaeureethylester

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:2766-16-7 SDS

2766-16-7Relevant academic research and scientific papers

A terphenyl phosphine as a highly efficient ligand for palladium-catalysed amination of aryl halides with 1° anilines

Shi, Ji-cheng,Zhang, Lixue,Zhou, Fabin

, p. 238 - 243 (2021/09/07)

A terphenyl phosphine ligand (2,6-bis(2,4,6-triisopropylphenyl)phenyl-dicyclohexylphosphine, TXPhos) and its supported palladium complex [(TXPhos)(allyl)PdCl] have been developed and the catalyst system is highly efficient in amination of aryl halides with 1° anilines, especially effective for densely functionalized substrates including both partners possessing ortho-ester, acetyl, nitrile and nitro groups. With the TXPhos-supported catalyst system, many partner combinations have been unprecedentedly realized and the base scope has been even extended to KOAc, which is even the best choice in the amination of 2-nitrochlorobenzene.

Design of multifaceted antioxidants: Shifting towards anti-inflammatory and antihyperlipidemic activity

Kourounakis, Angeliki,Lambrinidis, George,Tzara, Ariadni

, (2021/08/30)

Oxidative stress and inflammation are two conditions that coexist in many multifactorial diseases such as atherosclerosis and neurodegeneration. Thus, the design of multifunctional compounds that can concurrently tackle two or more therapeutic targets is an appealing approach. In this study, the basic NSAID structure was fused with the antioxidant moieties 3,5-di-tert-butyl-4-hydroxybenzoic acid (BHB), its reduced alcohol 3,5-di-tert-butyl- 4-hydroxybenzyl alcohol (BHBA), or 6-hydroxy-2,5,7,8-tetramethylchromane-2-carboxylic acid (Trolox), a hydrophilic analogue of α-tocopherol. Machine learning algorithms were utilized to validate the potential dual effect (anti-inflammatory and antioxidant) of the designed analogues. Derivatives 1-17 were synthesized by known esterification methods, with good to excellent yields, and were pharmacologically evaluated both in vitro and in vivo for their antioxidant and anti-inflammatory activity, whereas selected compounds were also tested in an in vivo hyperlipidemia protocol. Furthermore, the activity/binding affinity of the new compounds for lipoxygenase-3 (LOX-3) was studied not only in vitro but also via molecular docking simulations. Experimental results demonstrated that the antioxidant and anti-inflammatory activities of the new fused molecules were increased compared to the parent molecules, while molecular docking simulations validated the improved activity and revealed the binding mode of the most potent inhibitors. The purpose of their design was justified by providing a potentially safer and more efficient therapeutic approach for multifactorial diseases.

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