677713-01-8

Basic information

• Product Name: 3-(Trifluoromethoxy)benzoic acid ethyl ester
• Synonyms: 3-(Trifluoromethoxy)benzoic acid ethyl ester;ethyl 3-(trifluoroMethoxy)benzoate
• CAS NO: 677713-01-8
• Molecular Formula: C₁₀H₉F₃O₃
• Molecular Weight: 234.1718696
• Mol File: 677713-01-8.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 224℃
• Flash Point: 87℃
• Appearance: /
• Density: 1.271
• Vapor Pressure: 0.0917mmHg at 25°C
• Refractive Index: 1.453
• CAS DataBase Reference: 3-(Trifluoromethoxy)benzoic acid ethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(Trifluoromethoxy)benzoic acid ethyl ester(677713-01-8)
• EPA Substance Registry System: 3-(Trifluoromethoxy)benzoic acid ethyl ester(677713-01-8)

Safety Data

• Hazardous Substances Data: 677713-01-8(Hazardous Substances Data)

Usage

General Description

3-(Trifluoromethoxy)benzoic acid ethyl ester, also known as ethyl 3-(trifluoromethoxy)benzoate, is a chemical compound with the molecular formula C10H9F3O3. It is a white solid with a molecular weight of 234.17 g/mol. This chemical is commonly used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It is also utilized as a building block in the production of various organic compounds. 3-(Trifluoromethoxy)benzoic acid ethyl ester is considered to be of low toxicity, but it should be handled with care and in accordance with safety protocols to avoid any potential hazards.

InChI:InChI=1/C10H9F3O3/c1-2-15-9(14)7-4-3-5-8(6-7)16-10(11,12)13/h3-6H,2H2,1H3

Upstream product

• 64-17-5 ethanol 
• 86270-03-3 3-(trifluoromethoxy)benzoyl chloride 
• 1014-81-9 3-(trifluoromethoxy)benzoic acid 

Downstream Products

• 1417848-71-5 C₁₅H₁₂ClF₃N₄O₃ 
• 1417848-73-7 C₁₅H₁₀ClF₃N₄O₂ 
• 1417848-82-8 C₁₅H₁₀ClF₃N₄O₂ 
• 1417848-92-0 C₁₅H₁₀ClF₃N₄O₂ 
• 1417840-38-0 C₂₂H₂₅F₃N₆O₂*CH₂O₂ 
• 321195-88-4 3-(trifluoromethoxy)benzohydrazide 
• 1417847-24-5 C₁₆H₁₁ClF₅N₅O₂ 
• 1417847-35-8 C₁₆H₁₁ClF₅N₅O₂ 
• 1417848-68-0 C₁₅H₁₀ClF₃N₄O₂ 
• 1431537-46-0 N-(thiazol-2-yl)-3-(3-(trifluoromethoxy)phenyl)-[1,2,4]triazolo[4,3-b]pyridazine-6-carboxamide 
• 1431538-20-3 3-(3-(trifluoromethoxy)phenyl)-[1,2,4]triazolo[4,3-b]pyridazine-6-carboxylic acid 

Relevant articles and documents

O-Trifluoromethylation of Phenols: Access to Aryl Trifluoromethyl Ethers by O-Carboxydifluoromethylation and Decarboxylative Fluorination

A new strategy for the synthesis of aryl trifluoromethyl ethers (ArOCF3) by combining O-carboxydifluoromethylation of phenols and subsequent decarboxylative fluorination is reported. This protocol allows easy construction of functionalized trifluoromethoxybenzenes and trifluoromethylthiolated arenes (ArSCF3) in moderate to good yields. Moreover, it utilizes accessible and inexpensive reagents sodium bromodifluoroacetate and SelectFluor II and, thus, is practical for O-trifluoromethylation of phenols. The potential application of this method is demonstrated with the preparation of a plant-growth regulator, Flurprimidol.

SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS

Provided herein are novel substituted bicyclic aza-heterocycle sirtuin-modulating compounds and methods of use thereof. The sirtuin-modulating compounds may be used for increasing the lifespan of a cell, and treating and/or preventing a wide variety of diseases and disorders including, for example, diseases or disorders related to aging or stress, diabetes, obesity, neurodegenerative diseases, cardiovascular disease, blood clotting disorders, inflammation, cancer, and/or flushing as well as diseases or disorders that would benefit from increased mitochondrial activity. Also provided, are compositions comprising a sirtuin-modulating compound in combination with another therapeutic agent.

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