14736-50-6

Basic information

• Product Name: 2-(2-METHOXY-2-OXOETHYL)BENZOIC ACID
• Synonyms: 2-(2-METHOXY-2-OXOETHYL)BENZOIC ACID;Benzeneacetic acid, 2-carboxy-, a-Methyl ester;2-(2-Methoxy-2-oxoethyl)
• CAS NO: 14736-50-6
• Molecular Formula: C₁₀H₁₀O₄
• Molecular Weight: 194.18
• Mol File: 14736-50-6.mol
• Article Data: 24

Chemical Properties

• Melting Point: 98-100 °C(Solv: ethyl ether (60-29-7); hexane (110-54-3))
• Boiling Point: 320.9°C at 760 mmHg
• Flash Point: 126.5°C
• Appearance: /
• Density: 1.254g/cm³
• Vapor Pressure: 0.000128mmHg at 25°C
• Refractive Index: 1.547
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 3.69±0.36(Predicted)
• CAS DataBase Reference: 2-(2-METHOXY-2-OXOETHYL)BENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(2-METHOXY-2-OXOETHYL)BENZOIC ACID(14736-50-6)
• EPA Substance Registry System: 2-(2-METHOXY-2-OXOETHYL)BENZOIC ACID(14736-50-6)

Safety Data

• Hazardous Substances Data: 14736-50-6(Hazardous Substances Data)

Usage

General Description

2-(2-Methoxy-2-oxoethyl)benzoic acid is a chemical compound with the molecular formula C10H10O4. It is an organic compound that is commonly used in the production of pharmaceuticals and as a reagent in organic synthesis. The compound is a carboxylic acid derivative that contains a benzene ring and a methoxy group attached to a two-carbon chain with a carbonyl group. This chemical is used in the manufacturing of various drugs and is also employed as a building block in the synthesis of other complex organic molecules. It is important for the pharmaceutical industry and research in organic chemistry and chemical synthesis.

InChI:InChI=1/C10H10O4/c1-14-9(11)6-7-4-2-3-5-8(7)10(12)13/h2-5H,6H2,1H3,(H,12,13)

Upstream product

• 118-90-1 ortho-methylbenzoic acid 
• 616-38-6 carbonic acid dimethyl ester 
• 95-13-6 1-indene 
• 169887-46-1 1-Hydroxy-4-methoxy-4,5-dihydro-1H-2,3-benzodioxepin 
• 74-88-4 methyl iodide 
• 67-56-1 methanol 
• 703-59-3 homophthalic anhydride 
• 124-41-4 sodium methylate 
• 716-43-8 dimethyl homophthalate 
• 76-05-1 trifluoroacetic acid 
• 4090-69-1 3-methoxy-1H-isochromen-1-one 
• 89-51-0 Homophthalic acid 

Downstream Products

• 122775-39-7 2-(ω-phenylsulfonylacetonyl)benzoic acid 
• 337380-72-0 [2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]acetic acid methyl ester 
• 2289-03-4 1-oxo-1H-isochromene-3-carboxylic acid 
• 1584160-59-7 4-methylenehexyl 2-(2-methoxy-2-oxoethyl)benzoate 
• 1584160-53-1 pent-4-en-1-yl 2-(2-methoxy-2-oxoethyl)benzoate 
• 1452840-78-6 5'-O-{[N-(2-ethanoxylato)benzoyl]sulfamoyl}cytidine sodium salt 
• 1452840-77-5 5'-O-{[N-(2-methyl ethanoate)benzoyl]sulfamoyl}cytidine 
• 1225572-40-6 C₁₅H₈ClFN₂O₂ 
• 86671-87-6 2-(4-Chlorophenyl)-1(2H)-phthalazinone-4-carboxylic acid chloride 
• 1415648-03-1 4-amino-2-(2,4-difluorophenyl)phthalazin-1(2H)-one 
• 1415648-02-0 4-amino-2-(4-fluorophenyl)phthalazin-1(2H)-one 
• 1415648-01-9 4-amino-2-(4-chlorophenyl)phthalazin-1(2H)-one 

Relevant articles and documents

Design, Synthesis, and Structural Analysis of Cladosporin-Based Inhibitors of Malaria Parasites

Here we have described a systematic structure activity relationship (SAR) of a set of compounds inspired from cladosporin, a tool compound that targets parasite (Plasmodium falciparum) lysyl tRNA synthetase (KRS). Four sets of analogues, synthesized based on point changes in the chemical scaffold of cladosporin and other logical modifications and hybridizations, were assessed using high throughput enzymatic and parasitic assays along with in vitro pharmacokinetics. Co-crystallization of the most potent compound in our series (CL-2) with PfKRS revealed its structural basis of enzymatic binding and potency. Further, we report that CL-2 has performed better than cladosporin in terms of metabolic stability. It thus represents a new lead for further optimization toward the development of antimalarial drugs. Collectively, along with a lead compound, the series offers insights on how even the slightest chemical modification might play an important role in enhancing or decreasing the potency of a chemical scaffold.

Highly chemoselective esterification reactions and Boc/THP/TBDMS discriminating deprotections under samarium(III) catalysis

The usefulness of SmCl3 as an excellent catalyst for chemoselective esterifications and selective removal of acid sensitive protecting groups such as Boc, THP, and TBDMS in the presence of one another is demonstrated through suitable examples.

A domino N-amidoacylation/aldol-type condensation approach to the synthesis of the topo-I inhibitor rosettacin and derivatives

(Chemical Equation Presented) The pot, atom, and step-economic synthesis of Rosettacin topo-I poison and its derivatives has been achieved using a novel domino N-amidoacylation/aldol-type condensation, followed by decarboxylation of the ester function. Th