methyl 3-[(chlorosulfonyl)methyl]benzoate

Base Information

• Chemical Name: methyl 3-[(chlorosulfonyl)methyl]benzoate
• CAS No.: 174961-63-8
• Molecular Formula: C9H9ClO4S
• Molecular Weight: 248.68300
• Mol file: 174961-63-8.mol

Synonyms:methyl 3-[(chlorosulfonyl)methyl]benzoate;

Chemical Property of methyl 3-[(chlorosulfonyl)methyl]benzoate

Chemical Property:

• PSA: 68.82000
• LogP: 2.62260

Purity/Quality:

97%min ^*data from raw suppliers

METHYL 3-[(CHLOROSULFONYL)METHYL]BENZOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of methyl 3-[(chlorosulfonyl)methyl]benzoate

There total 4 articles about methyl 3-[(chlorosulfonyl)methyl]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: 78.0%

3-methoxycarbonylbenzyl bromide (1129-28-8) → methyl 3-[(chlorosulfonyl)methyl]benzoate (174961-63-8)

Guidance literature:

3-methoxycarbonylbenzyl bromide; With tetrabutylammomium bromide; sodium sulfite; In water; Reflux;

With phosphorus pentachloride; trichlorophosphate; In chloroform; at 80 ℃; for 4h;

DOI:10.1016/j.ejmech.2020.112338

Reference yield:

C10H12N2O2S*H(1+) → methyl 3-[(chlorosulfonyl)methyl]benzoate (174961-63-8)

Guidance literature:

C₁₀H₁₂N₂O₂S*H⁽¹⁺⁾; With hydrogenchloride; In acetonitrile; at 0 ℃; for 0.25h;

With N-chloro-succinimide; In acetonitrile; at 20 ℃; for 0.5h;

DOI:10.1021/jacs.9b10646

Reference yield:

C9H10O5S → methyl 3-[(chlorosulfonyl)methyl]benzoate (174961-63-8)

Guidance literature:

With thionyl chloride; N,N-dimethyl-formamide; In dichloromethane; for 1.5h;

DOI:10.1021/acs.jmedchem.9b00327

upstream raw materials:

3-methoxycarbonylbenzyl bromide

Downstream raw materials:

[((3-carboxyphenyl)methanesulfonyl)amino]methaneboronic acid

pinacol [3-(methoxycarbonyl)phenylmethanesulfonylamino]methaneboronate

Refernces

• 1、 Erdmann, Frank,Günther, Stefan,Ghazy, Ehab,Hügle, Martin,Herp, Daniel,Jung, Manfred,Morales, Elizabeth R.,Robaa, Dina,Romier, Christophe,Schmidt, Matthias,Schmidtkunz, Karin,Sippl, Wolfgang,Zeyen, Patrik. "Design, synthesis, and biological evaluation of dual targeting inhibitors of histone deacetylase 6/8 and bromodomain BRPF1". supporting information. . Retrieved 2020/06/03.
• 2、 -. "Methods for the use of inhibitors of cytosolic phospholipase A2 in the treatment of thrombosis". Page/Page column 15. . Retrieved 2010/11/29.