Benzyl (Chloromethyl) Succinate

Base Information

• Chemical Name: Benzyl (Chloromethyl) Succinate
• CAS No.: 143869-67-4
• Molecular Formula: C12H13ClO4
• Molecular Weight: 256.686
• DSSTox Substance ID: DTXSID50445129
• Wikidata: Q82263463
• Mol file: 143869-67-4.mol

Synonyms:Benzyl (Chloromethyl) Succinate;143869-67-4;1-O-benzyl 4-O-(chloromethyl) butanedioate;MFCD26391015;Benzyl(Chloromethyl)Succinate;Butanedioic acid, chloromethyl phenylmethyl ester;3-benzyloxycarbonylpropionic acid chloromethyl ester;SCHEMBL3730231;DTXSID50445129;CSQJMNMWWYYBBG-UHFFFAOYSA-N;AC2213;CS-12396;SY056810;Succinic acid benzyl ester chloromethyl ester;A1-02787;Butanedioic acid, 1-(chloromethyl) 4-(phenylmethyl) ester

Chemical Property of Benzyl (Chloromethyl) Succinate

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 256.0502366
• Heavy Atom Count: 17
• Complexity: 249

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)CCC(=O)OCCl

Technology Process of Benzyl (Chloromethyl) Succinate

There total 5 articles about Benzyl (Chloromethyl) Succinate 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: 70.0%

succinic acid benzyl ester (methylsulfanyl)methyl ester (650638-36-1) → 3-benzyloxycarbonylpropionic acid chloromethyl ester (143869-67-4)

Guidance literature:

With sulfuryl dichloride; In dichloromethane;

DOI:10.1016/j.bmc.2003.09.003

Reference yield:

chlorosulfuric acid chloromethyl ester (49715-04-0) + succinic acid monobenzyl ester (103-40-2) → 3-benzyloxycarbonylpropionic acid chloromethyl ester (143869-67-4)

Guidance literature:

succinic acid monobenzyl ester; With sodium hydrogencarbonate; tetrabutylammonium sulfate; In dichloromethane; water; at 0 ℃; for 0.25h;

chlorosulfuric acid chloromethyl ester; In dichloromethane; water; at 0 - 20 ℃; for 5.5h;

Reference yield:

Chloroiodomethane (593-71-5) + succinic acid monobenzyl ester (103-40-2) → 3-benzyloxycarbonylpropionic acid chloromethyl ester (143869-67-4)

Guidance literature:

With tetra(n-butyl)ammonium hydroxide; In 1,4-dioxane; dichloromethane; toluene;

upstream raw materials:

Succinic acid benzyl ester phenylsulfanylmethyl ester

succinic acid benzyl ester (methylsulfanyl)methyl ester

succinic acid monobenzyl ester

Chloroiodomethane

Downstream raw materials:

succinic acid benzyl ester (5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)methyl ester

Succinic acid 5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl ester pentafluorophenyl ester