3-(4-Methoxyphenoxy)benzoic acid

Base Information

• Chemical Name: 3-(4-Methoxyphenoxy)benzoic acid
• CAS No.: 117423-75-3
• Molecular Formula: C14H12O4
• Molecular Weight: 244.247
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID50347159
• Nikkaji Number: J2.546.174F
• Wikidata: Q82120783
• Mol file: 117423-75-3.mol

Synonyms:3-(4-Methoxyphenoxy)benzoic acid;117423-75-3;3-(4-Methoxyphenoxy)benzoicacid;m-(p-Methoxyphenoxy)benzoic acid;SCHEMBL2857877;DTXSID50347159;3-(4'-methoxyphenoxy)benzoic acid;3-(4-Methoxyphenoxy)benzoic acid #;AR1577;MFCD03840104;AKOS002685383;AS-45162;CS-0172600;A910467

Chemical Property of 3-(4-Methoxyphenoxy)benzoic acid

Chemical Property:

• PSA: 55.76000
• LogP: 3.18570
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 244.07355886
• Heavy Atom Count: 18
• Complexity: 271

Purity/Quality:

97% ^*data from raw suppliers

3-(4-Methoxyphenoxy)benzoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)O

Technology Process of 3-(4-Methoxyphenoxy)benzoic acid

There total 8 articles about 3-(4-Methoxyphenoxy)benzoic 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: 89.0%

m-bromobenzoic acid (585-76-2) + 4-methoxy-phenol (150-76-5) → 3-(4-methoxyphenoxy)benzoic acid (117423-75-3)

Guidance literature:

With copper(l) iodide; N,N-dimethylglycine hydrochoride; caesium carbonate; In 1,4-dioxane; at 90 ℃; for 24h;

DOI:10.1021/ol0350947

Reference yield: 89.0%

ethyl 3-(4-methoxyphenoxy)benzoate → 3-(4-methoxyphenoxy)benzoic acid (117423-75-3)

Guidance literature:

With water; sodium hydroxide; In tetrahydrofuran; ethanol; Reflux;

DOI:10.1016/j.bmc.2020.115961

Reference yield: 80.0%

3-(4-methoxyphenoxy)benzaldehyde (62373-80-2) → 3-(4-methoxyphenoxy)benzoic acid (117423-75-3)

Guidance literature:

With sodium hydroxide; silver(l) oxide; In water; at 30 ℃; for 1.5h;

DOI:10.1021/tx100167x

upstream raw materials:

1-(4-methoxyphenoxy)-3-methylbenzene

3-(4-methoxyphenoxy)benzaldehyde

m-bromobenzoic acid

4-methoxy-phenol

Downstream raw materials:

5-<3-(ethoxycarbonyl)phenoxy>-2-(decyloxy)benzenepropanoic acid

5-(3-Carboxyphenoxy)-2-(decyloxy)benzenepropanoic acid

ethyl 3-<4-(decyloxy)-3-(3-hydroxypropyl)phenoxy>benzoate

ethyl 3-<3-allyl-4-(decyloxy)phenoxy>benzoate