22138-72-3

Basic information

• Product Name: 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid
• Synonyms: 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid;(2E)-3-(4-Fluorophenyl)-2-methylprop-2-enoic acid;(2E)-3-(4-Fluorophenyl)-2-methylacrylicacid
• CAS NO: 22138-72-3
• Molecular Formula: C₁₀H₉FO₂
• Molecular Weight: 180.1756632
• Product Categories: pharmacetical
• Mol File: 22138-72-3.mol
• Article Data: 37

Chemical Properties

• Melting Point: 151-153 °C
• Boiling Point: 287.2±15.0 °C(Predicted)
• Appearance: /
• Density: 1.237±0.06 g/cm3(Predicted)
• PKA: 4.85±0.10(Predicted)
• CAS DataBase Reference: 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid(22138-72-3)
• EPA Substance Registry System: 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid(22138-72-3)

Safety Data

• Hazardous Substances Data: 22138-72-3(Hazardous Substances Data)

Usage

General Description

3-(4-Fluoro-phenyl)-2-methyl-acrylic acid is a chemical compound with the molecular formula C11H9FO2. It is a derivative of acrylic acid, containing a 4-fluoro-phenyl and a 2-methyl group in its structure. 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid has potential applications in the field of organic synthesis and pharmaceuticals, and its properties make it suitable for use as a building block in the creation of various compounds. 3-(4-Fluoro-phenyl)-2-methyl-acrylic acid may also have potential uses in the development of new materials and chemical processes. Its unique structure and potential reactivity make it a compound of interest for further study and exploration in various scientific and industrial fields.

Upstream product

• 516-05-2 methyl-propanedioic acid 
• 459-57-4 4-fluorobenzaldehyde 
• 123-62-6 propionic acid anhydride 
• 134294-41-0 ethyl 3-(4-fluorophenyl)-2-methyl-2-propenoate 
• 64-18-6 formic acid 
• 18826-59-0 1-(4-fluorophenyl)-prop-1-yne 

Downstream Products

• 22138-73-4 3-(4-fluorophenyl)-2-methylpropanoic acid 
• 1361029-47-1 (E)-3-(4-fluorophenyl)-2-methyl-1-(3-methyl-1H-indol-1-yl)prop-2-en-1-one 
• 1361029-57-3 1-(4-fluorophenyl)-2,9-dimethyl-3H-pyrrolo[1,2-a]indol-3-one 
• 1361029-68-6 (Z)-methyl 3-(4-fluorophenyl)-2-methyl-3-(3-methyl-1H-indol-2-yl)acrylate 
• 1346513-25-4 C₂₅H₂₇FO₂ 

Relevant articles and documents

Synthesis, spectroscopic characterization, X-ray structures, biological screenings, DNA interaction study and catalytic activity of organotin(IV) 3-(4-flourophenyl)-2-methylacrylic acid derivatives

A series of organotin(IV) carboxylate complexes [Me2SnL 2] (1), [Bu2SnL2] (2), [Oct2SnL 2] (3), [Me3SnL] (4), [Bu3SnL] (5) and [Ph 3SnL] (6), where L = O2C(CH3)CCHC 6H4F have been successfully synthesized and characterized by FT-IR, NMR (1H, 13C) and single crystal analysis. The ligand coordinates to tin atom via carboxylate group. Compound 1 and 4 have also been studied by single crystal XRD analysis. The synthesized compounds were screened for their biological activities including anti-bacterial, anti-fungal, anti-tumor and cytotoxicity. The compounds 4-6 exhibit excellent anti-bacterial, anti-fungal and anti-tumor activities. The ligand binds with DNA double helix by hydrogen bonding between the ligand and the base pairs in DNA typically to N3 of adenine and O2 of thymine as well as partial intercalation of aromatic ring into the base pairs of DNA. The complexes also interact with DNA via intercalation of aromatic ring into the base pairs of DNA. The catalytic activity of compounds 46 was assessed in transesterification of triglycerides in rocket seed oil into biodiesel. The choice of these compounds is the Lewis acid nature of tin atom. The samples were taken in regular interval of 1, 8, 16 and 24 h and % age conversion was determined by 1H NMR. All the tested compounds showed good catalytic activity in the order 4 > 5 > 6.

Copper-Photocatalyzed Contra-Thermodynamic Isomerization of Polarized Alkenes

The contra-thermodynamic isomerization of α- and β-substituted cinnamate derivatives catalyzed by the Cu(OAc)2/rac-BINAP complex under blue light irradiation is reported. The use of an oxazolidinone template, which favored the complexation of the copper catalyst to the substrate, allowed the E → Z isomerization of the catalytically formed chromophore under simple and robust reaction conditions in good to excellent ratios. The mechanism of this process based on the transient formation of a chromophore was also studied.

Pd-Catalyzed α-Selective C-H Functionalization of Olefins: En Route to 4-Imino-β-Lactams

Pd-catalyzed α-olefinic C-H activation of simple α,β-unsaturated olefins has been developed. 4-imino-β-lactam derivatives were readily synthesized via activation of α-olefinic C-H bonds with excellent cis stereoselectivity. A wide range of heterocycles at the β-position are compatible with this reaction. The product of 4-imino-β-lactam derivatives can be readily converted to 2-aminoquinoline which exists extensively in pharmaceutical drugs and natural products.