3686-55-3

Basic information

• Product Name: Methyl 2-ethoxybenzoate
• Synonyms: METHYL-O-ETHOXYBENZOATE;METHYL 2-ETHOXYBENZOATE;2-ETHOXYBENZOIC ACID METHYL ESTER;O-ETHOXY BENZOIC ACID METHYL ESTER;O-ETHOXY BENZOIC ACID MENTHYL ESTER;NISTC3686553;R-172;Methyl 2-ethoxybenzo
• CAS NO: 3686-55-3
• Molecular Formula: C₁₀H₁₂O₃
• Molecular Weight: 180.2
• EINECS: 204-513-2
• Product Categories: Aromatic Esters;Acids & Esters;Anisoles, Alkyloxy Compounds & Phenylacetates
• Mol File: 3686-55-3.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 245 °C
• Flash Point: 102.1 °C
• Appearance: /
• Density: 1.11
• Vapor Pressure: 0.0139mmHg at 25°C
• Refractive Index: 1.5180 to 1.5220
• CAS DataBase Reference: Methyl 2-ethoxybenzoate(CAS DataBase Reference)
• NIST Chemistry Reference: Methyl 2-ethoxybenzoate(3686-55-3)
• EPA Substance Registry System: Methyl 2-ethoxybenzoate(3686-55-3)

Safety Data

• Hazardous Substances Data: 3686-55-3(Hazardous Substances Data)

Usage

General Description

Methyl 2-ethoxybenzoate is a chemical compound with the molecular formula C10H12O3. It is commonly used as a flavoring agent and fragrance in the food and cosmetic industries. This colorless to pale yellow liquid is known for its sweet, floral, and fruity aroma, making it a popular ingredient in perfumes, lotions, and various personal care products. Methyl 2-ethoxybenzoate is also used as a solvent and as an intermediate in the synthesis of other chemicals. It is important to handle and store this compound with care, as it can be harmful if swallowed, inhaled, or comes into contact with the skin.

InChI:InChI=1/C10H12O3/c1-3-13-9-7-5-4-6-8(9)10(11)12-2/h4-7H,3H2,1-2H3

Upstream product

• 67-56-1 methanol 
• 134-11-2 2-ethoxybenzoic acid 
• 75-03-6 ethyl iodide 
• 119-36-8 methyl salicylate 
• 74-96-4 ethyl bromide 
• 64-67-5 diethyl sulfate 

Downstream Products

• 938-73-8 2-ethoxybenzamide 
• 134-11-2 2-ethoxybenzoic acid 
• 89-44-1 3-(2-ethoxyphenyl)-3-oxopropanenitrile 
• 108463-10-1 1-(2-Ethoxyphenyl)-3-(1,2,3,4-tetrahydro-1-oxo-2-naphthalenyl)-1,3-propanedione 
• 108463-20-3 5,6-Dihydro-2-(2-ethoxyphenyl)-4H-naphtho<1,2-b>pyran-4-one 
• 21018-13-3 2-ethoxybenzoic acid hydrazide 
• 69-72-7 salicylic acid 
• 838814-08-7 2-(5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-ylthio)-1-phenylethanone 
• 931911-75-0 1-(4-bromophenyl)-2-(5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-ylthio)ethanone 
• 19982-38-8 2-(o.etossifenil)-5-mercapto-1,3,4-oxadiazolo 
• 19982-41-3 N'-(2-ethoxy-benzoyl)-hydrazinecarbodithioic acid; potassium salt 
• 200575-17-3 methyl 5-(chlorosulfonyl)-2-ethoxybenzoate 

Relevant articles and documents

Process for preparing O-ethoxybenzoic acid chloride (by machine translation)

The method comprises the following steps of (1) ethylation reaction, (2) alkali hydrolysis reaction and (3) acyl chlorination reaction, and is simple in reaction step, strong in operability, mild in reaction conditions, simple in process, easy to control, convenient to use and capable of easily controlling the byproduct HCl and CO. 2 The method is simple in process, convenient to operate, low in raw material cost, high in yield, good in quality and convenient for industrial production. (by machine translation)

Ultrasound-assisted, one-pot, three-component synthesis and antibacterial activities of novel indole derivatives containing 1,3,4-oxadiazole and 1,2,4-triazole moieties

Thirteen novel indole derivatives were efficiently synthesized through ultrasound irradiation by using 4-amino-5-(1H-indol-3-yl)-4H-[1,2,4]triazole-3-thiol (8) and 2-mercapto-5-substituted-1,3,4-oxadiazoles (5a-m). Compared with conventional and microwave methods, yields increased to 82-93%, and reaction times decreased to 15-35 min. The structures of these novel compounds were characterized by spectral data and elemental analysis. Two out of the synthesized compounds (10f and 10l) exhibited excellent activity against Staphylococcus aureus and Escherichia coli, and thus warrant further research.

Synthesis, biological evaluation and molecular docking studies of novel 2-(1,3,4-oxadiazol-2-ylthio)-1-phenylethanone derivatives

In present study, a series of new 2-(1,3,4-oxadiazol-2-ylthio)-1- phenylethanone derivatives (6a-6x) as potential focal adhesion kinase (FAK) inhibitors were synthesized. The bioassay assays demonstrated that compound 6i showed the most potent activity, which inhibited the growth of MCF-7 and A431 cell lines with IC50 values of 140 ± 10 nM and 10 ± 1 nM, respectively. Compound 6i also exhibited significant FAK inhibitory activity (IC50 = 20 ± 1 nM). Docking simulation was performed to position compound 6i into the active site of FAK to determine the probable binding model.