2-{Benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid

Base Information

Chemical Name:2-{Benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid
CAS No.:195052-28-9
Molecular Formula:C16H17NO5S
Molecular Weight:335.381
Hs Code.:
DSSTox Substance ID:DTXSID60352097
Nikkaji Number:J873.787H
Wikidata:Q82129073
Mol file:195052-28-9.mol

Synonyms:2-{benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid;195052-28-9;2-[benzyl-(4-methoxyphenyl)sulfonylamino]acetic acid;CBMicro_000976;Cambridge id 5889759;Oprea1_067802;Oprea1_333092;SCHEMBL5092519;DTXSID60352097;UFCYEQXQMJKGQB-UHFFFAOYSA-N;SMSF0009383;AKOS000297252;CB02296;BIM-0001054.P001;SR-01000480240;SR-01000480240-1

Suppliers and Price of 2-{Benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid

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

Total 0 raw suppliers

Chemical Property of 2-{Benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:335.08274382
Heavy Atom Count:23
Complexity:473

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)O

Technology Process of 2-{Benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid

There total 4 articles about 2-{Benzyl[(4-methoxyphenyl)sulfonyl]amino}acetic acid 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: 99.0%

: 161315-25-9
ethyl 2-[[4-methoxybenzenesulfonyl](benzyl)amino]acetate

: 195052-28-9
2-{benzyl [(4-methoxyphenyl)sulfonyl]amino}acetic acid

Guidance literature:: ethyl 2-[[4-methoxybenzenesulfonyl](benzyl)amino]acetate; With sodium hydroxide; In ethanol; water; at 20 ℃; for 16h;

With hydrogenchloride; In water;

Reference yield:

: 98-68-0
4-methoxy-phenyl-sulphonyl chloride

: 195052-28-9
2-{benzyl [(4-methoxyphenyl)sulfonyl]amino}acetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: NaHCO₃ / acetone; H₂O / 20 °C

2: Et₃N / acetonitrile / 2 h / Heating

With sodium hydrogencarbonate; triethylamine; In water; acetone; acetonitrile; 1: Condensation / 2: Alkylation;
DOI:10.1016/S0223-5234(00)00127-6

Reference yield:

: 100-51-6,185532-71-2
benzyl alcohol

: 195052-28-9
2-{benzyl [(4-methoxyphenyl)sulfonyl]amino}acetic acid

Guidance literature:: With 1,1'-carbonyldipiperidine; tributylphosphine; trifluoroacetic acid; Yield given. Multistep reaction; 1.) THF, CH₂Cl₂, rt., 12 h; 2.) CH₂Cl₂;
DOI:10.1055/s-1997-5776