Methyl 2-chloro-2-methoxyacetate

Base Information

• Chemical Name: Methyl 2-chloro-2-methoxyacetate
• CAS No.: 13157-96-5
• Molecular Formula: C4H7ClO3
• Molecular Weight: 138.551
• Hs Code.: 2918990090
• European Community (EC) Number: 813-235-6
• Mol file: 13157-96-5.mol

Synonyms:methyl 2-chloro-2-methoxyacetate;13157-96-5;Methyl 2-chloro-2-methoxy-acetate;METHYL CHLORO-METHOXY ACETATE;MFCD11044959;methyl chloro(methoxy)acetate;SCHEMBL2582323;DCOWHZYIFORKFC-UHFFFAOYSA-N;BBL102450;STL556252;AKOS006308104;MS-20442;FT-0724032;EN300-221380;F71970

Chemical Property of Methyl 2-chloro-2-methoxyacetate

Chemical Property:

• PSA: 35.53000
• LogP: 0.37070
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 138.0083718
• Heavy Atom Count: 8
• Complexity: 83.4

Purity/Quality:

97% ^*data from raw suppliers

MethylChloro(methoxy)acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(C(=O)OC)Cl

Technology Process of Methyl 2-chloro-2-methoxyacetate

There total 7 articles about Methyl 2-chloro-2-methoxyacetate 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: 100.0%

Methyl dimethoxyacetate (89-91-8) → methyl 2-chloro-2-methoxyacetate (13157-96-5)

Guidance literature:

With iodine; acetyl chloride; at 50 ℃; for 18h; Product distribution / selectivity;

Reference yield:

Methyl dimethoxyacetate (89-91-8) + acetyl chloride (75-36-5) → methyl 2-chloro-2-methoxyacetate (13157-96-5)

Guidance literature:

With iodine; at 20 - 50 ℃; for 1.75h;

Reference yield:

α-Methoxy-α-acetoxyessigsaeure-methylester (24607-11-2) → methyl 2-chloro-2-methoxyacetate (13157-96-5)

Guidance literature:

With phosphorus pentachloride;

upstream raw materials:

Methyl dimethoxyacetate

α-Methoxy-α-acetoxyessigsaeure-methylester

α-Methoxy-α-phenoxy-essigsaeuremethylester

acetyl chloride

Downstream raw materials:

Methyl dimethoxyacetate

methyl 2,2-bis(1-methyl-1H-indol-3-yl)acetate

1,1'-dimethyl-2',3'-dihydro-1H,1'H-2,3'-biindolyl

3-(4-tert-Butyl-cyclohexyl)-2-methoxy-propionic acid methyl ester

Refernces

• 1、 -. "NOVEL BIAROMATIC COMPOUNDS THAT MODULATE PPAR-RECEPTORS". Page/Page column 18; 25. . Retrieved 2009/01/23.
• 2、 Toshima, Kazunobu,Yamaguchi, Hiroyuki,Jyojima, Takaaki,Noguchi, Yasunobu,Nakata, Masaya,Matsumura, Shuichi. "Total synthesis of bafilomycin A1. 2. The assemblage and completion of the synthesis". . p. 1073 - 1076. Retrieved 2007/10/03.