883531-28-0

Basic information

• Product Name: 2-Fluoro-4-methoxyphenylacetic acid
• Synonyms: 4-(Carboxymethyl)-3-fluoroanisole;2-fluoro-4-methoxylphenylacetic acid;2-(2-fluoro-4-methoxyphenyl)acetic acid;2-Fluoro-4-Methoxy acid;2-Fluoro-4-Methoxyphenylacetic acid, JRD, 97%
• CAS NO: 883531-28-0
• Molecular Formula: C₉H₉FO₃
• Molecular Weight: 184.17
• EINECS: 200-258-5
• Product Categories: Fluorine series
• Mol File: 883531-28-0.mol

Chemical Properties

• Boiling Point: 290.6 °C at 760 mmHg
• Flash Point: 129.5 °C
• Appearance: /
• Density: 1.269 g/cm³
• Vapor Pressure: 0.000943mmHg at 25°C
• Refractive Index: 1.519
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 4.17±0.10(Predicted)
• CAS DataBase Reference: 2-Fluoro-4-methoxyphenylacetic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 2-Fluoro-4-methoxyphenylacetic acid(883531-28-0)
• EPA Substance Registry System: 2-Fluoro-4-methoxyphenylacetic acid(883531-28-0)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 883531-28-0(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
2-Fluoro-4-methoxyphenylacetic acid is utilized as a key intermediate in organic synthesis for the creation of various chemical compounds. Its unique structure allows for versatile reactions, making it a valuable component in the synthesis of complex organic molecules.
Used in Pharmaceutical Research:
In the pharmaceutical industry, 2-Fluoro-4-methoxyphenylacetic acid serves as a crucial building block for the development of new drugs. Its distinct chemical properties contribute to the design and synthesis of novel pharmaceutical agents, potentially leading to breakthroughs in medicinal chemistry.
Used in Drug Discovery:
2-Fluoro-4-methoxyphenylacetic acid's reactivity and properties make 2-Fluoro-4-methoxyphenylacetic acid an indispensable tool in drug discovery. It aids researchers in understanding the mechanisms of action and optimizing the pharmacological profiles of potential drug candidates, thereby accelerating the process of bringing new therapeutics to market.
Used in the Study of Organic Chemistry:
2-Fluoro-4-methoxyphenylacetic acid is also employed in academic and research settings to explore the fundamental principles of organic chemistry. Its unique structure and reactivity provide insights into reaction mechanisms, helping to advance the field of organic chemistry and contribute to the understanding of molecular interactions.

InChI:InChI=1/C9H9FO3/c1-13-7-3-2-6(4-9(11)12)8(10)5-7/h2-3,5H,4H2,1H3,(H,11,12)

Upstream product

• 74457-86-6 1-(2-fluoro-4-methoxyphenyl)-1-ethanone 
• 1403674-64-5 2,2,2-trichloro-1-(2-fluoro-4-methoxyphenyl)ethanol 

Downstream Products

• 1403674-65-6 2-(2-fluoro-4-methoxyphenyl)acetic acid chloride 
• 1403674-94-1 C₂₅H₂₂FNO₃ 
• 1181692-22-7 (R)-1-(6-(3-fluoro-4-(2-(2-methylpyrrolidin-1-yl)ethyl)phenyl)-3,4-dihydroisoquinolin-2(1H)-yl)ethanone trifluoroacetate 
• 1147392-15-1 (R)-3-fluoro-4-(2-(2-methylpyrrolidin-1-yl)ethyl)phenyl trifluoromethanesulfonate 
• 1147392-09-3 (R)-1-(2-fluoro-4-methoxyphenethyl)-2-methylpyrrolidine 
• 68886-07-7 (2-fluoro-4-hydroxylphenyl)acetic acid 
• 1147392-04-8 2-(2-fluoro-4-methoxyphenyl)ethanol 

Relevant articles and documents

Influence of chlorine or fluorine substitution on the estrogenic properties of 1-alkyl-2,3,5-tris(4-hydroxyphenyl)-1H-pyrroles

In continuation of our previous work, several 1-alkyl-2,3,5-tris(4- hydroxyphenyl)aryl-1H-pyrroles with chlorine or fluorine substituents in the aryl residues were synthesized and tested for estrogen receptor (ER) binding at isolated ERα/ERβ receptors (HAP assay) and in transactivation assays using ERα-positive MCF-7/2a as well as U2-OS/ERα and U2-OS/ERβ cells. In the competition experiment at ERα the compounds displayed very high relative binding affinities of up to 37% (determined for 8m) but with restricted subtype selectivity (e.g., ERα/ERβ (8m) = 9). The highest estrogenic potency in ERα-positive MCF-7/2a cells was determined for 2,3,5-tris(2-fluoro-4-hydroxyphenyl)-1-propyl-1H-pyrrole 8m (EC50 = 23 nM), while in U2-OS/ERα cells 2-(2-fluoro-4-hydroxyphenyl)-3,5-bis(4- hydroxyphenyl)-1-propyl-1H-pyrrole 8b (EC50 = 0.12 nM) was the most potent agonist, only 30-fold less active than estradiol (E2, EC50 = 0.004 nM). In U2-OS/ERβ cells for all pyrroles no transactivation could be observed, which indicates that they are selective ERα agonists in cellular systems.