Ethyl ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxoacetate

Base Information

• Chemical Name: Ethyl ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxoacetate
• CAS No.: 81717-15-9
• Molecular Formula: C12H13 N3 O7 S
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID501002141
• Wikidata: Q82996200
• Mol file: 81717-15-9.mol

Synonyms:BRN 5133956;81717-15-9;Ethyl ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxoacetate;((4-(((Aminoacetyl)amino)sulfonyl)phenyl)amino)oxoacetic acid ethyl ester;Acetic acid, ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxo-, ethyl ester;C12H13N3O7S;DTXSID501002141;C12-H13-N3-O7-S;N-(4-{[Amino(oxo)acetyl]sulfamoyl}phenyl)-2-ethoxy-2-oxoethanimidic acid

Chemical Property of Ethyl ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxoacetate

Chemical Property:

• PSA: 173.60000
• Density: 1.532g/cm³
• LogP: 1.29990
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 343.04742094
• Heavy Atom Count: 23
• Complexity: 588

Purity/Quality:

((4-(((AMINOACETYL)AMINO)SULFONYL)PHENYL)AMINO)OXOACETIC ACID ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C(=O)N

Technology Process of Ethyl ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxoacetate

There total 1 articles about Ethyl ((4-(((aminooxoacetyl)amino)sulfonyl)phenyl)amino)oxoacetate 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: 79.1%

sulfanilyl-oxalamide (68640-61-9) + Ethyl oxalyl chloride (4755-77-5) → N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-oxalamic acid ethyl ester (81717-15-9)

Guidance literature:

With triethylamine; In acetic acid; Ambient temperature;

DOI:10.1007/BF00761607

Reference yield: 84.1%

N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-oxalamic acid ethyl ester (81717-15-9) → N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-oxalamide (81717-24-0)

Guidance literature:

With ammonia; In ethanol; Ambient temperature;

DOI:10.1007/BF00761607

Reference yield: 80.2%

N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-oxalamic acid ethyl ester (81717-15-9) → N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-N'-hydroxy-oxalamide (81717-49-9)

Guidance literature:

With hydroxylamine; In ethanol; Ambient temperature;

DOI:10.1007/BF00761607

upstream raw materials:

sulfanilyl-oxalamide

Ethyl oxalyl chloride

Downstream raw materials:

N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-oxalamide

N-[4-(Aminooxalyl-sulfamoyl)-phenyl]-N'-hydroxy-oxalamide

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