Methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate

Base Information

Chemical Name:Methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate
CAS No.:448201-66-9
Molecular Formula:C14H12N2O6S
Molecular Weight:336.325
Hs Code.:
DSSTox Substance ID:DTXSID10404792

Synonyms:methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate;448201-66-9;SCHEMBL5467189;DTXSID10404792;GYMCWTSRACBFPJ-UHFFFAOYSA-N;AKOS002952843

Suppliers and Price of Methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate

Supply Marketing:

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

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Chemical Property of Methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate

Chemical Property:

XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:336.04160728
Heavy Atom Count:23
Complexity:539

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Technology Process of Methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate

There total 1 articles about Methyl 2-{[(3-nitrophenyl)sulfonyl]amino}benzoate 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: 74.0%

: 134-20-3
2-carbomethoxyaniline

: 121-51-7
3-nitrobenzenesulphonyl chloride

: 448201-66-9
methyl 2-(3-nitrophenylsulfonamido)benzoate

Guidance literature:: With pyridine; In tetrahydrofuran; at 20 ℃; for 9h;
DOI:10.3390/molecules18066883

Reference yield: 86.2%

: 448201-66-9
methyl 2-(3-nitrophenylsulfonamido)benzoate

: 400090-90-6
2-(3-nitro-benzenesulfonylamino)-benzoic acid

Guidance literature:: With sodium hydroxide; In ethanol; water; at 80 ℃; for 8h;
DOI:10.3390/molecules18066883

Reference yield:

: 448201-66-9
methyl 2-(3-nitrophenylsulfonamido)benzoate

: 1446489-40-2
N-(2,4-dichlorophenyl)-2-(3-nitrophenylsulfonamido)benzamide

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hydroxide / ethanol; water / 8 h / 80 °C

2.1: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / N,N-dimethyl-formamide / 2 h / 20 °C

2.2: 12 h / 20 °C

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; sodium hydroxide; In ethanol; water; N,N-dimethyl-formamide;
DOI:10.3390/molecules18066883