Methyl 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoate

Base Information

• Chemical Name: Methyl 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoate
• CAS No.: 60376-98-9
• Molecular Formula: C17H17ClO5
• Molecular Weight: 336.772
• DSSTox Substance ID: DTXSID50604299

Synonyms:Methyl 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoate;60376-98-9;SCHEMBL10951141;DTXSID50604299

Chemical Property of Methyl 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoate

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 336.0764513
• Heavy Atom Count: 23
• Complexity: 349

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)Cl)O

Technology Process of Methyl 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoate

There total 2 articles about Methyl 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoate 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%

4-chlorophenyl 2,3-epoxypropyl ether (2212-05-7) + methyl 4-hydroxylbenzoate (99-76-3,156291-94-0) → 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoic acid methyl ester (60376-98-9)

Guidance literature:

With tetrabutylammomium bromide; potassium carbonate; palladium dichloride; In water; at 60 ℃; for 2.5h;

DOI:10.1039/c3cc42507j

Reference yield:

→ 4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoic acid methyl ester (60376-98-9)

Guidance literature:

Reference yield:

4-[3-(4-chlorophenoxy)-2-hydroxypropoxy]benzoic acid methyl ester (60376-98-9) → 4-[3-(4-Chloro-phenoxy)-2-oxo-propoxy]-benzoic acid methyl ester (70193-50-9)

Guidance literature:

With dimethyl sulfoxide; dicyclohexyl-carbodiimide; trifluoroacetic acid; In pyridine;

upstream raw materials:

4-chlorophenyl 2,3-epoxypropyl ether

methyl 4-hydroxylbenzoate

Downstream raw materials:

4-[3-(4-Chloro-phenoxy)-2-hydroxy-propoxy]-benzoic acid 2-methoxy-ethyl ester

4-[3-(4-Chloro-phenoxy)-2-oxo-propoxy]-benzoic acid methyl ester

4-[3-(4-Chloro-phenoxy)-2-hydroxy-propoxy]-benzoic acid

4-[3-(4-Chloro-phenoxy)-2-hydroxy-propoxy]-N-hydroxy-benzamide

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