N-benzyl-2-tosylacetamide

Base Information

• Chemical Name: N-benzyl-2-tosylacetamide
• CAS No.: 330173-08-5
• Molecular Formula: C16H17NO3S
• Molecular Weight: 303.382
• DSSTox Substance ID: DTXSID401322366
• Nikkaji Number: J1.449.753F
• ChEMBL ID: CHEMBL1415451
• Mol file: 330173-08-5.mol

Synonyms:N-benzyl-2-tosylacetamide;330173-08-5;N-benzyl-2-[(4-methylphenyl)sulfonyl]acetamide;N-BENZYL-2-(4-METHYLBENZENESULFONYL)ACETAMIDE;N-benzyl-2-(4-methylphenyl)sulfonylacetamide;MLS001162207;CHEMBL1415451;DTXSID401322366;HMS2965M11;STK238484;AKOS002066368;SMR000670668;F2536-0202

Chemical Property of N-benzyl-2-tosylacetamide

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 303.09291458
• Heavy Atom Count: 21
• Complexity: 427

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NCC2=CC=CC=C2

Technology Process of N-benzyl-2-tosylacetamide

There total 3 articles about N-benzyl-2-tosylacetamide 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: 90.0%

sodium 4-methylbenzenesulfinate (824-79-3) + chloroacetyl chloride (79-04-9) + benzylamine (100-46-9) → N-benzyl-2-(4-methylphenylsulfonyl)acetamide (330173-08-5)

Guidance literature:

chloroacetyl chloride; benzylamine; In tetrahydrofuran;

sodium 4-methylbenzenesulfinate; In 1,4-dioxane; water; Heating;

DOI:10.1016/S0040-4039(00)01845-1

Reference yield: 85.0%

N-benzyl-2-chloroacetamide (2564-06-9) + sodium 4-methylbenzenesulfinate (824-79-3) → N-benzyl-2-(4-methylphenylsulfonyl)acetamide (330173-08-5)

Guidance literature:

DOI:10.3987/com-03-9812

Reference yield:

N-benzyl-2-chloroacetamide (2564-06-9) + sodium tosylate (657-84-1) → N-benzyl-2-(4-methylphenylsulfonyl)acetamide (330173-08-5)

Guidance literature:

In 1,4-dioxane; water; for 10h; Heating;

DOI:10.1016/S0040-4020(02)00475-1 DOI:10.3987/com-02-9626

upstream raw materials:

sodium 4-methylbenzenesulfinate

chloroacetyl chloride

benzylamine

N-benzyl-2-chloroacetamide

Downstream raw materials:

1-benzyl-3-phenyl-5-(toluene-4-sulfonyl)-piperidine-2,6-dione

1-benzyl-3-(4-methylphenylsulfonyl)piperidine-2,6-dione

1-Benzyl-3-[1-phenyl-meth-(E)-ylidene]-5-(toluene-4-sulfonyl)-piperidine-2,6-dione