N-(2-Amino-5-nitrophenyl)propanamide

Base Information

• Chemical Name: N-(2-Amino-5-nitrophenyl)propanamide
• CAS No.: 88374-33-8
• Molecular Formula: C9H11N3O3
• Molecular Weight: 209.205
• DSSTox Substance ID: DTXSID30571975
• Wikidata: Q82460189

Synonyms:N-(2-Amino-5-nitrophenyl)propanamide;88374-33-8;DTXSID30571975

Chemical Property of N-(2-Amino-5-nitrophenyl)propanamide

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 209.08004122
• Heavy Atom Count: 15
• Complexity: 252

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])N

Technology Process of N-(2-Amino-5-nitrophenyl)propanamide

There total 2 articles about N-(2-Amino-5-nitrophenyl)propanamide 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: 84.0%

propionyl chloride (79-03-8) + 4-Nitrophenylene-1,2-diamine (99-56-9) → N-(2-amino-5-nitrophenyl)propionamide (88374-33-8)

Guidance literature:

With triethylamine; In tetrahydrofuran; at -40 - 20 ℃;

DOI:10.1021/jo050670t

Reference yield:

4-Nitrophenylene-1,2-diamine (99-56-9) + C8H14O4 → N-(2-amino-5-nitrophenyl)propionamide (88374-33-8)

Guidance literature:

In tetrahydrofuran; at -15 - 20 ℃;

DOI:10.1021/jo981985u

Reference yield:

N-(2-amino-5-nitrophenyl)propionamide (88374-33-8) → N-thiopropionyl-2-amino-5-nitroaniline (220641-91-8)

Guidance literature:

With tetraphosphorus decasulfide; sodium carbonate; In tetrahydrofuran; at 0 - 20 ℃; for 3h;

DOI:10.1021/jo981985u

upstream raw materials:

4-Nitrophenylene-1,2-diamine

propionyl chloride

Downstream raw materials:

N-thiopropionyl-2-amino-5-nitroaniline

5-nitro-2-ethyl-1H-benzo[d]imidazole

2-(4-((2-ethyl-5-nitro-1H-benzo[d]imidazol-1-yl)methyl)-1H-indol-1-yl)benzonitrile

2-(4-((2-ethyl-5-nitro-1H-benzo[d]imidazol-1-yl)methyl)-1H-indol-1-yl)benzoic acid

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