5-Isoxazoleacetic acid, 3,4-bis(4-methoxyphenyl)-, methyl ester

Base Information

• Chemical Name: 5-Isoxazoleacetic acid, 3,4-bis(4-methoxyphenyl)-, methyl ester
• CAS No.: 131454-49-4
• Molecular Formula: C20H19NO5
• Molecular Weight: 353.375
• DSSTox Substance ID: DTXSID60448601
• Wikidata: Q82267670
• Mol file: 131454-49-4.mol

Synonyms:131454-49-4;Methyl 2-(3,4-bis(4-methoxyphenyl)isoxazol-5-yl)acetate;5-Isoxazoleacetic acid, 3,4-bis(4-methoxyphenyl)-, methyl ester;SCHEMBL9124704;DTXSID60448601;GMMZHQIUFDUEPA-UHFFFAOYSA-N;AKOS000280086;methyl (3,4-bis(4-methoxyphenyl)-isoxazol-5-yl]acetate;methyl [3,4-bis(4-methoxyphenyl)isoxazol-5-yl]acetate;5-methoxycarbonylmethyl-3,4-bis(4-methoxyphenyl)isoxazole

Chemical Property of 5-Isoxazoleacetic acid, 3,4-bis(4-methoxyphenyl)-, methyl ester

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 353.12632271
• Heavy Atom Count: 26
• Complexity: 444

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=C(ON=C2C3=CC=C(C=C3)OC)CC(=O)OC

Technology Process of 5-Isoxazoleacetic acid, 3,4-bis(4-methoxyphenyl)-, methyl ester

There total 2 articles about 5-Isoxazoleacetic acid, 3,4-bis(4-methoxyphenyl)-, methyl ester 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: 90.0%

methyl 5-hydroxyimino-4,5-bis(4-methoxyphenyl)-3-pentenoate → 5-methoxycarbonylmethyl-3,4-bis(4-methoxyphenyl)isoxazole (131454-49-4)

Guidance literature:

With sodium chloride; sulfuric acid; potassium carbonate; In cobalt(II) diacetate tetrahydrate; acetic acid;

Reference yield:

→ 5-methoxycarbonylmethyl-3,4-bis(4-methoxyphenyl)isoxazole (131454-49-4)

Guidance literature:

Reference yield:

5-methoxycarbonylmethyl-3,4-bis(4-methoxyphenyl)isoxazole (131454-49-4) → mofezolac (78967-07-4)

Guidance literature:

With hydrogenchloride; sodium hydroxide; sodium chloride;

Downstream raw materials:

mofezolac

Refernces

• 1、 -. "α, β-unsaturated ketones and ketoxime derivatives". . . Retrieved 2008/06/13.