Methyl 4-(2-methoxy-2-oxoethoxy)benzoate

Base Information

• Chemical Name: Methyl 4-(2-methoxy-2-oxoethoxy)benzoate
• CAS No.: 35005-30-2
• Molecular Formula: C11H12O5
• Molecular Weight: 224.213
• DSSTox Substance ID: DTXSID90358320
• Nikkaji Number: J802.896F
• Wikidata: Q82138804
• ChEMBL ID: CHEMBL1399324
• Mol file: 35005-30-2.mol

Synonyms:methyl 4-(2-methoxy-2-oxoethoxy)benzoate;35005-30-2;4-Methoxycarbonylmethoxy-benzoic acid, methyl ester;MLS000062957;SCHEMBL4262664;CHEMBL1399324;DTXSID90358320;HMS2361C12;MFCD03714432;STL444523;AKOS003349332;methyl4-(2-methoxy-2-oxoethoxy)benzoate;LS-07633;SMR000071644;CS-0320279;4-Methoxycarbonylmethoxy-benzoic Acid Methyl Ester

Chemical Property of Methyl 4-(2-methoxy-2-oxoethoxy)benzoate

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 224.06847348
• Heavy Atom Count: 16
• Complexity: 243

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Methyl 4-(2-methoxy-2-oxoethoxy)benzoate

There total 5 articles about Methyl 4-(2-methoxy-2-oxoethoxy)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: 95.0%

methyl chloroacetate (96-34-4) + methyl 4-hydroxylbenzoate (99-76-3,156291-94-0) → methyl 4-(2-methoxy-2-oxoethoxyl)benzoate (35005-30-2)

Guidance literature:

With potassium carbonate; potassium iodide; In acetonitrile; at 82 ℃; for 8h; Inert atmosphere;

DOI:10.1002/pola.28089 DOI:10.1039/c7ra01810j

Reference yield: 95.0%

methanol (67-56-1) + 4-carboxymethoxy-benzoic acid (19360-67-9) → methyl 4-(2-methoxy-2-oxoethoxyl)benzoate (35005-30-2)

Guidance literature:

With sulfuric acid;

Reference yield: 90.0%

methanol (67-56-1) + 4-carboxymethoxy-benzoic acid (19360-67-9) → 4-(methoxycarbonylmethoxy)benzoic acid (63787-32-6) + methyl 4-(2-methoxy-2-oxoethoxyl)benzoate (35005-30-2)

Guidance literature:

With thionyl chloride; at 25 - 27 ℃; for 30.5h;

upstream raw materials:

methanol

4-carboxymethoxy-benzoic acid

methyl chloroacetate

methyl 4-hydroxylbenzoate

Downstream raw materials:

(2,4-dinitro-phenoxy)-acetic acid methyl ester

4-carbamoylmethoxy-benzoic acid methyl ester

methyl 4-(2-methoxy-2-oxo-ethoxy)-3-nitrobenzoate

4-methoxycarbonylmethoxy-3,5-dinitro-benzoic acid methyl ester

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