2,2'-{[2-(4-Nitroanilino)-2-oxoethyl]azanediyl}diacetic acid

Base Information

• Chemical Name: 2,2'-{[2-(4-Nitroanilino)-2-oxoethyl]azanediyl}diacetic acid
• CAS No.: 69163-50-4
• Molecular Formula: C12H13N3O7
• Molecular Weight: 311.251
• DSSTox Substance ID: DTXSID20498985
• Wikidata: Q82349383

Synonyms:69163-50-4;DTXSID20498985;2,2'-{[2-(4-Nitroanilino)-2-oxoethyl]azanediyl}diacetic acid

Chemical Property of 2,2'-{[2-(4-Nitroanilino)-2-oxoethyl]azanediyl}diacetic acid

Chemical Property:

• XLogP3: -1.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 311.07534976
• Heavy Atom Count: 22
• Complexity: 425

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC(=O)CN(CC(=O)O)CC(=O)O)[N+](=O)[O-]

Technology Process of 2,2'-{[2-(4-Nitroanilino)-2-oxoethyl]azanediyl}diacetic acid

There total 1 articles about 2,2'-{[2-(4-Nitroanilino)-2-oxoethyl]azanediyl}diacetic 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:

→ N-(4-nitrophenylcarbamoylmethyl)iminodiacetic acid (69163-50-4)

Guidance literature:

Nitrilotriessigsaeure, 1.) Acetanhydrid, 2.) p-Nitranilin;

DOI:10.1002/jps.2600671029

Reference yield: 78.3%

N-(4-nitrophenylcarbamoylmethyl)iminodiacetic acid (69163-50-4) → {[(4-Amino-phenylcarbamoyl)-methyl]-carboxymethyl-amino}-acetic acid; compound with ammonia

Guidance literature:

With ammonium hydroxide; hydrogen; palladium on activated charcoal; for 16h; under 2068.6 Torr; pH 8;

DOI:10.1002/jps.2600700424

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