2-Fluoro-4,6-dimethoxybenzoic acid

Base Information

• Chemical Name: 2-Fluoro-4,6-dimethoxybenzoic acid
• CAS No.: 286434-45-5
• Molecular Formula: C₉H₉FO₄
• Molecular Weight: 200.166
• European Community (EC) Number: 856-324-5
• Nikkaji Number: J1.410.841F
• Mol file: 286434-45-5.mol

Synonyms:SCHEMBL18170324;2-fluoro-4,6-dimethoxybenzoic acid;EN300-7352466;Z3243604262;286434-45-5

Chemical Property of 2-Fluoro-4,6-dimethoxybenzoic acid

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 200.04848693
• Heavy Atom Count: 14
• Complexity: 209

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=C(C(=C1)F)C(=O)O)OC

Technology Process of 2-Fluoro-4,6-dimethoxybenzoic acid

There total 2 articles about 2-Fluoro-4,6-dimethoxybenzoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

3,5-dimethoxyfluorobenzene (52189-63-6) → 2-fluoro-4,6-dimethoxybenzoic acid (286434-45-5)

Guidance literature:

Multi-step reaction with 2 steps

1: sec-butyllithium, TMEDA / tetrahydrofuran / -78 °C

2: KOH / methanol

With potassium hydroxide; N,N,N,N,-tetramethylethylenediamine; sec.-butyllithium; In tetrahydrofuran; methanol;

DOI:10.1021/jo00302a011

Reference yield:

2-Fluoro-4,6-dimethoxy-benzoic acid ethyl ester → 2-fluoro-4,6-dimethoxybenzoic acid (286434-45-5)

Guidance literature:

With potassium hydroxide; In methanol; Yield given;

DOI:10.1021/jo00302a011

Reference yield:

2-fluoro-4,6-dimethoxybenzoic acid (286434-45-5) → 2-Fluoro-4,6-dimethoxy-benzoyl chloride

Guidance literature:

With oxalyl dichloride; N,N-dimethyl-formamide; In tetrahydrofuran;

DOI:10.1021/jo00302a011

upstream raw materials:

3,5-dimethoxyfluorobenzene

Downstream raw materials:

(2-Fluoro-4,6-dimethoxy-phenyl)-(2-hydroxy-4,5-dimethoxy-phenyl)-methanone

2-Fluoro-4,6-dimethoxy-benzoic acid 2-bromo-4,5-dimethoxy-phenyl ester

1-(2-fluoro-4,6-dihydroxyphenyl)-2-(4-hydroxyphenyl)ethanone

1-(2-fluoro-6-hydroxy-4-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)-2-(4-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)ethanone