4-methyl-N-octylbenzenesulfonamide

Base Information

• Chemical Name: 4-methyl-N-octylbenzenesulfonamide
• CAS No.: 1150-31-8
• Molecular Formula: C15H25NO2S
• Molecular Weight: 283.435
• DSSTox Substance ID: DTXSID70389056
• Nikkaji Number: J897.880H
• Wikidata: Q82184443
• Mol file: 1150-31-8.mol

Synonyms:4-methyl-N-octylbenzenesulfonamide;1150-31-8;Benzenesulfonamide, 4-methyl-N-octyl-;N-Octyl-p-toluenesulfonamide;N-octyl-toluene-4-sulfonamide;SCHEMBL223156;N--Octyl-toluene-4-sulfonamide;DTXSID70389056;ZOKHEWHJVBLKRN-UHFFFAOYSA-N;AKOS000668856

Chemical Property of 4-methyl-N-octylbenzenesulfonamide

Chemical Property:

• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 283.16060021
• Heavy Atom Count: 19
• Complexity: 314

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCNS(=O)(=O)C1=CC=C(C=C1)C

Technology Process of 4-methyl-N-octylbenzenesulfonamide

There total 14 articles about 4-methyl-N-octylbenzenesulfonamide 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: 100.0%

N-fluoro-4-methyl-N-octylbenzenesulfonamide → N-octyl-4-methylbenzenesulfonamide (1150-31-8)

Guidance literature:

With copper acetylacetonate; indium; disodium hydrogenphosphate; 1,10-Phenanthroline; indium(III) benzenethiolate; In 1,2-dichloro-ethane; at 40 ℃; for 9h; Irradiation;

DOI:10.1039/c9sc04169a

Reference yield: 99.0%

trioctylborane (3248-78-0) + [N-(p-tolylsulfonyl)imino]phenyliodinane (55962-05-5) → N-octyl-4-methylbenzenesulfonamide (1150-31-8)

Guidance literature:

In tetrahydrofuran; for 3h; Ambient temperature;

DOI:10.1055/s-1993-25887

Reference yield: 92.0%

n-Octylamine (111-86-4) + p-toluenesulfonyl chloride (98-59-9) → N-octyl-4-methylbenzenesulfonamide (1150-31-8)

Guidance literature:

In dichloromethane; triethylamine; at 20 ℃; for 2h;

DOI:10.1016/S0040-4020(97)00920-4

upstream raw materials:

oct-1-ene

chloroamine-T

trioctylborane

[N-(p-tolylsulfonyl)imino]phenyliodinane

Downstream raw materials:

N-octyl-N-hexadecyl-p-toluenesulfonamide

4-methyl-N-octyl-N-(phenylethynyl)benzenesulfonamide

n-Octylamine

n-octylamine hydrochloride