N-(2-hydroxybutyl)-4-methylbenzenesulfonamide

Base Information

Chemical Name:N-(2-hydroxybutyl)-4-methylbenzenesulfonamide
CAS No.:918954-47-9
Molecular Formula:C11H17NO3S
Molecular Weight:243.327
Hs Code.:
DSSTox Substance ID:DTXSID60396794
Nikkaji Number:J2.689.743B

Synonyms:N-(2-hydroxybutyl)-4-methylbenzenesulfonamide;918954-47-9;SCHEMBL12169291;DTXSID60396794;N-(2-Hydroxybutyl)-p-toluenesulfonamide;AB00006555-01

Suppliers and Price of N-(2-hydroxybutyl)-4-methylbenzenesulfonamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of N-(2-hydroxybutyl)-4-methylbenzenesulfonamide

Chemical Property:

PSA：74.78000
LogP:2.51590
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:243.09291458
Heavy Atom Count:16
Complexity:289

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(CNS(=O)(=O)C1=CC=C(C=C1)C)O

Technology Process of N-(2-hydroxybutyl)-4-methylbenzenesulfonamide

There total 4 articles about N-(2-hydroxybutyl)-4-methylbenzenesulfonamide 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: 89.0%

: 13552-21-1
2-hydroxy-butylamine

: 98-59-9
p-toluenesulfonyl chloride

: 918954-47-9
N-(2-hydroxobutyl)-4-methylbenzenesulfonamide

Guidance literature:: With triethylamine; In chloroform; at 20 ℃; for 18h;
DOI:10.1002/anie.200602782

Reference yield: 89.0%

: N-[2-{(cyclohexylideneamino)oxy}butyl]-4-methylbenzenesulfonamide

: 918954-47-9
N-(2-hydroxobutyl)-4-methylbenzenesulfonamide

Guidance literature:: With lithium aluminium tetrahydride; In diethyl ether; at 20 ℃; for 48h;
DOI:10.1039/c4cc05655h

Reference yield:

: 98-59-9
p-toluenesulfonyl chloride

: 918954-47-9
N-(2-hydroxobutyl)-4-methylbenzenesulfonamide

Guidance literature:: Multi-step reaction with 3 steps

1: sodium azide / water; acetone / 11 h / 0 - 20 °C

2: bis[dichloro(pentamethylcyclopentadienyl)iridium(III)]; Ag⁽¹⁺⁾*C₂HF₆NO₄S₂; cesium acetate / 1,2-dichloro-ethane / 24 h / 60 °C

3: lithium aluminium tetrahydride / diethyl ether / 48 h / 20 °C

With lithium aluminium tetrahydride; sodium azide; bis[dichloro(pentamethylcyclopentadienyl)iridium(III)]; Ag⁽¹⁺⁾*C₂HF₆NO₄S₂; cesium acetate; In diethyl ether; water; 1,2-dichloro-ethane; acetone;
DOI:10.1039/c4cc05655h