2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate

Base Information

Chemical Name:2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate
CAS No.:51786-15-3
Molecular Formula:C11H14NO4S2-
Molecular Weight:289.376
Hs Code.:2935009090
DSSTox Substance ID:DTXSID10966103
Wikidata:Q82948445
Mol file:51786-15-3.mol

Synonyms:DTXSID10966103;2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate

Suppliers and Price of 2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
4-(METHYLTHIO)-2-[(PHENYLSULFONYL)AMINO]BUTANOIC ACID 95.00%
5G
$ 1005.43

American Custom Chemicals Corporation
4-(METHYLTHIO)-2-[(PHENYLSULFONYL)AMINO]BUTANOIC ACID 95.00%
2.5G
$ 852.21

American Custom Chemicals Corporation
4-(METHYLTHIO)-2-[(PHENYLSULFONYL)AMINO]BUTANOIC ACID 95.00%
1G
$ 648.81

Total 3 raw suppliers

Chemical Property of 2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate

Chemical Property:

Vapor Pressure:4.87E-11mmHg at 25°C
Boiling Point:505.5°Cat760mmHg
Flash Point:259.5°C
PSA：117.15000
Density:g/cm³
LogP:2.64290
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:288.03642527
Heavy Atom Count:18
Complexity:352

Purity/Quality:

99% ^*data from raw suppliers

4-(METHYLTHIO)-2-[(PHENYLSULFONYL)AMINO]BUTANOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSCCC(C(=O)[O-])NS(=O)(=O)C1=CC=CC=C1
Isomeric SMILES:CSCC[C@@H](C(=O)[O-])NS(=O)(=O)C1=CC=CC=C1

Technology Process of 2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate

There total 2 articles about 2-[(Benzenesulfonyl)amino]-4-(methylsulfanyl)butanoate 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%

: 63-68-3,26062-47-5,58576-49-1
L-methionine

: 98-09-9
benzenesulfonyl chloride

: 51786-15-3
4-[(methylsulfanyl)-2-(phenylsulfonyl)amino]butanoic acid

Guidance literature:: With triethylamine; In dichloromethane; at 0 - 20 ℃; for 12h;

Reference yield:

: 98-09-9
benzenesulfonyl chloride

: 59-51-8,26062-47-5,58576-49-1
DL-methionine

: 51786-15-3
N-benzenesulphonyl-dl-metheonine

Guidance literature:: With sodium hydroxide;

Reference yield: 97.1%

: 107-10-8,42939-71-9
propylamine

: 51786-15-3
4-[(methylsulfanyl)-2-(phenylsulfonyl)amino]butanoic acid

: 2-benzenesulfonamido-4-(methylsulfanyl)-N-propylbutanamide

Guidance literature:: With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; In toluene; for 12h; Dean-Stark; Reflux;
DOI:10.1016/j.bioorg.2019.103265