4-Methyl-N-(3-methylbut-2-en-1-yl)-N-phenylbenzene-1-sulfonamide

Base Information

• Chemical Name: 4-Methyl-N-(3-methylbut-2-en-1-yl)-N-phenylbenzene-1-sulfonamide
• CAS No.: 132704-03-1
• Molecular Formula: C18H21NO2S
• Molecular Weight: 315.436
• DSSTox Substance ID: DTXSID60562811
• Mol file: 132704-03-1.mol

Synonyms:132704-03-1;DTXSID60562811;4-Methyl-N-(3-methylbut-2-en-1-yl)-N-phenylbenzene-1-sulfonamide

Chemical Property of 4-Methyl-N-(3-methylbut-2-en-1-yl)-N-phenylbenzene-1-sulfonamide

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 315.12930009
• Heavy Atom Count: 22
• Complexity: 460

Purity/Quality:

85.0-99.8% ^*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)N(CC=C(C)C)C2=CC=CC=C2

Technology Process of 4-Methyl-N-(3-methylbut-2-en-1-yl)-N-phenylbenzene-1-sulfonamide

There total 2 articles about 4-Methyl-N-(3-methylbut-2-en-1-yl)-N-phenylbenzene-1-sulfonamide 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: 61.0%

phenyl toluenesulfonamide (68-34-8) + prenyl bromide (870-63-3) → 4-methyl-N-(3-methylbut-2-enyl)-N-phenylbenzenesulfonamide (132704-03-1)

Guidance literature:

phenyl toluenesulfonamide; With caesium carbonate; In N,N-dimethyl-formamide; for 0.166667h;

prenyl bromide; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1055/s-0034-1379428

Reference yield:

N-(3-methylbut-2-enyl)aniline (27125-60-6) + p-toluenesulfonyl chloride (98-59-9) → 4-methyl-N-(3-methylbut-2-enyl)-N-phenylbenzenesulfonamide (132704-03-1)

Guidance literature:

Reference yield: 72.0%

4-methyl-N-(3-methylbut-2-enyl)-N-phenylbenzenesulfonamide (132704-03-1) → phenyl toluenesulfonamide (68-34-8)

Guidance literature:

With triethylsilane; trifluoroacetic acid; In dichloromethane; at 20 ℃; for 1h;

DOI:10.1055/s-0034-1379428

upstream raw materials:

N-(3-methylbut-2-enyl)aniline

p-toluenesulfonyl chloride

phenyl toluenesulfonamide

prenyl bromide

Downstream raw materials:

2-(1-Chloro-1-methyl-ethyl)-4-(toluene-4-sulfonyl)-3,4-dihydro-2H-benzo[1,4]thiazine

phenyl toluenesulfonamide