Cyclohexanecarboxamide, N-[[(4-methylphenyl)sulfonyl]phenylmethyl]-

Base Information

• Chemical Name: Cyclohexanecarboxamide, N-[[(4-methylphenyl)sulfonyl]phenylmethyl]-
• CAS No.: 372199-81-0
• Molecular Formula: C21H25NO3S
• Molecular Weight: 371.5
• DSSTox Substance ID: DTXSID90458172
• Nikkaji Number: J1.618.538H
• Mol file: 372199-81-0.mol

Synonyms:372199-81-0;Cyclohexanecarboxamide, N-[[(4-methylphenyl)sulfonyl]phenylmethyl]-;DTXSID90458172;N-(alpha-Tosylbenzyl)cyclohexanecarboxamide

Chemical Property of Cyclohexanecarboxamide, N-[[(4-methylphenyl)sulfonyl]phenylmethyl]-

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 371.15551483
• Heavy Atom Count: 26
• Complexity: 548

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC=CC=C2)NC(=O)C3CCCCC3

Technology Process of Cyclohexanecarboxamide, N-[[(4-methylphenyl)sulfonyl]phenylmethyl]-

There total 1 articles about Cyclohexanecarboxamide, N-[[(4-methylphenyl)sulfonyl]phenylmethyl]- 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:

benzaldehyde (100-52-7) + cyclohexylcarboxamide (1122-56-1) + sodium 4-methylbenzenesulfinate (824-79-3) → N-[(4-methylphenylsulfonyl)(phenyl)methyl]cyclohexanecarboxamide (372199-81-0)

Guidance literature:

With chloro-trimethyl-silane; In acetonitrile; at 23 ℃;

DOI:10.1021/ja0165943

Reference yield: 98.0%

pyridine-4-carbaldehyde (872-85-5) + N-[(4-methylphenylsulfonyl)(phenyl)methyl]cyclohexanecarboxamide (372199-81-0) → N-(2-oxo-1-phenyl-2-(pyridin-4-yl)-ethyl)-cyclohexanecarboxamide

Guidance literature:

With 5-(2-hydroxy-ethyl)-3,4-dimethyl-thiazolium; chloride; triethylamine; In dichloromethane; at 35 ℃; for 0.5h;

DOI:10.1021/ja0165943

Reference yield: 85.0%

benzaldehyde (100-52-7) + N-[(4-methylphenylsulfonyl)(phenyl)methyl]cyclohexanecarboxamide (372199-81-0) → cyclohexanecarboxylic acid (2-oxo-1,2-diphenyl-ethyl)-amide

Guidance literature:

With 3,4-dimethyl-2-(α-hydroxybenzyl)thiazolium iodide; triethylamine; In dichloromethane; at 35 ℃;

DOI:10.1021/ja0165943

upstream raw materials:

benzaldehyde

cyclohexylcarboxamide

sodium 4-methylbenzenesulfinate