180636-50-4

Basic information

• Product Name: Methyl 4-fluoro-3-methylbenzoate
• Synonyms: Methyl 4-fluoro-3-methylbenzoate;3-Methyl-4-Fluoro benzoic acidmethyl ester;3-Methyl-4-fluoroMethyl benzoate;Methyl 4-fluoro-m-toluate, 2-Fluoro-5-(methoxycarbonyl)toluene
• CAS NO: 180636-50-4
• Molecular Formula: C₉H₉FO₂
• Molecular Weight: 168.17
• Product Categories: blocks;Carboxes;FluoroCompounds
• Mol File: 180636-50-4.mol
• Article Data: 16

Chemical Properties

• Boiling Point: 219.2±20.0℃ (760 Torr)
• Flash Point: 84.1±16.7℃
• Appearance: /
• Density: 1.137±0.06 g/cm3 (20 ºC 760 Torr)
• Vapor Pressure: 0.121mmHg at 25°C
• Refractive Index: 1.491
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: Methyl 4-fluoro-3-methylbenzoate(CAS DataBase Reference)
• NIST Chemistry Reference: Methyl 4-fluoro-3-methylbenzoate(180636-50-4)
• EPA Substance Registry System: Methyl 4-fluoro-3-methylbenzoate(180636-50-4)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 180636-50-4(Hazardous Substances Data)

Usage

General Description

Methyl 4-fluoro-3-methylbenzoate is a chemical compound classified as an aromatic ester. It is characterized by the presence of a methyl group and a fluorine atom on a benzene ring, with a methyl ester functional group attached to the ring. It is used in the production of various organic compounds due to its reactivity. Methyl 4-fluoro-3-methylbenzoate is generally not found naturally, but is synthesized in laboratories for various applications in chemical industries. Safety and handling procedures must be followed while working with this chemical as it can cause skin and eye irritation.

InChI:InChI=1/C9H9FO2/c1-6-5-7(9(11)12-2)3-4-8(6)10/h3-5H,1-2H3

Upstream product

• 148547-19-7 4-Bromo-3-methylbenzoic acid methyl ester 
• 18595-14-7 methyl 4-amino-3-methylbenzoate 
• 67-56-1 methanol 
• 403-15-6 4-fluoro-3-methyl-benzoic acid 
• 74-88-4 methyl iodide 

Downstream Products

• 180637-18-7 3-methyl-4-(4-(1-methylpiperazin-4-ylsulfonyl)phenoxy)-benzoylguanidine 
• 1001922-31-1 1-(4-fluoro-3-methylphenyl)-2-(2-methylsulfanylpyrimidin-4-yl)ethanone 
• 1392466-96-4 4-(ethylsulfonyl)-3-methylbenzoic acid 
• 1346498-56-3 4-(isopropylsulfonyl)-3-methylbenzoic acid 
• 1339408-08-0 methyl 4-fluoro-3-methyl-5-nitrobenzoate 

Relevant articles and documents

Sulfone-Based Probes Unraveled Dihydrolipoamide S-Succinyltransferase as an Unprecedented Target in Phytopathogens

Target validation of current drugs remains the major challenge for target-based drug discovery, especially for agrochemical discovery. The bactericide 0 represents a novel lead structure and has shown potent efficacy against those diseases that are extremely difficult to control, such as rice bacterial leaf blight. However, no detailed target analysis of this bactericide has been reported. Here, we developed a panel of 0-derived probes 1?6, in which a conservative modification (alkyne tag) was introduced to keep the antibacterial activity of 0 and provide functionality for target identification via click chemistry. With these cell-permeable probes, we were able to discover dihydrolipoamide S-succinyltransferase (DLST) as an unprecedented target in living cells. The probes showed good preference for DLST, especially probe 1, which demonstrated distinct selectivity and reactivity. Also, we reported 0 as the first covalent DLST inhibitor, which has been used to confirm the involvement of DLST in the regulation of energy production.

G PROTEIN-COUPLED RECEPTOR KINASE 2 INHIBITORS AND METHODS FOR USE OF THE SAME

Disclosed herein are novel GRK2 inhibitors and methods for their use in treating or preventing heart disease, such as cardiac failure, cardiac hypertrophy, and hypertension. In particular, disclosed herein are compounds of Formula (I) and pharmaceutically

Metal-Catalyzed Carbon-Fluorine Bond Formation

One aspect of the invention relates to a metal-catalyzed conversion of aryl halides and sulfonates to the corresponding aryl fluorides. Another aspect of the invention relates to a metal-catalyzed conversion of heteroaryl halides and sulfonates to the corresponding heteroaryl fluorides. Another aspect of the invention relates to a metal-catalyzed conversion of vinyl halides and sulfonates to the corresponding vinyl fluorides. In certain embodiments, simple fluoride sources, such as AgF and CsF, are used. In certain embodiments, the transformations tolerate a wide range of functional groups, allowing for introduction of fluorine atoms into highly functionalized organic molecules.