N-[(4-chlorophenyl)methyl]methanesulfonamide

Base Information

• Chemical Name: N-[(4-chlorophenyl)methyl]methanesulfonamide
• CAS No.: 42060-30-0
• Molecular Formula: C₈H₁₀ClNO₂S
• Molecular Weight: 219.692
• DSSTox Substance ID: DTXSID801259599
• Nikkaji Number: J2.519.980D
• Mol file: 42060-30-0.mol

Synonyms:N-[(4-chlorophenyl)methyl]methanesulfonamide;N-(4-chlorobenzyl)methanesulfonamide;42060-30-0;Maybridge1_001697;SCHEMBL6338974;HMS546F03;CHEBI:195016;CRYRIYLKDDYXOB-UHFFFAOYSA-N;DTXSID801259599;CCG-45409;MFCD00117815;STL283918;n-(4-chlorobenzyl)-methanesulfonamide;AKOS000431115;N-[(4-chlorophenyl)methyl]methanesulonamide;CS-0150120;7N-006;D80716;SR-01000635177-1;JKY

Chemical Property of N-[(4-chlorophenyl)methyl]methanesulfonamide

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 219.0120774
• Heavy Atom Count: 13
• Complexity: 239

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CS(=O)(=O)NCC1=CC=C(C=C1)Cl

Technology Process of N-[(4-chlorophenyl)methyl]methanesulfonamide

There total 4 articles about N-[(4-chlorophenyl)methyl]methanesulfonamide 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%

4-chlorobenzylamine (104-86-9) + Methanesulfonic anhydride (7143-01-3) → N-(4-chloro-benzyl)-methanesulfonamide (42060-30-0)

Guidance literature:

4-chlorobenzylamine; Methanesulfonic anhydride; With triethylamine; In dichloromethane; at 20 ℃;

With sodium hydroxide; In methanol; water; at 20 ℃;

DOI:10.1016/j.tetlet.2008.08.054

Reference yield: 81.0%

methanesulfonyl chloride (124-63-0) + 4-chlorobenzylamine (104-86-9) → N-(4-chloro-benzyl)-methanesulfonamide (42060-30-0)

Guidance literature:

With triethylamine; In dichloromethane; for 2h;

DOI:10.1016/S0968-0896(01)00295-4

Reference yield: 81.0%

4-chlorobenzylamine (104-86-9) → N-(4-chloro-benzyl)-methanesulfonamide (42060-30-0)

Guidance literature:

With triethylamine; In 4-(dicyanomethylene)-2-methyl-6-(p-dimethylaminostyryl)-4H-pyran;

upstream raw materials:

methanesulfonyl chloride

4-chlorobenzylamine

Methanesulfonic anhydride

dimethyl sulfoxide

Downstream raw materials:

4'-Chloro-N-mesyl-2-nitrodibenzylamin

2-Amino-4'-chloro-N-mesyldibenzylamin

N-(4-chlorobenzyl)-2-hydroxy-4-(1-(triphenylmethyl)imidazol-4-yl)-1-butanesulfonamide

Carbonic acid tert-butyl ester 1-[(4-chloro-benzylsulfamoyl)-methyl]-decyl ester