4-(4-Nitrophenyl)butanamide

Base Information

• Chemical Name: 4-(4-Nitrophenyl)butanamide
• CAS No.: 61445-60-1
• Molecular Formula: C10H12N2O3
• Molecular Weight: 208.217
• DSSTox Substance ID: DTXSID50443403
• Wikidata: Q82261190
• Mol file: 61445-60-1.mol

Synonyms:4-(4-nitrophenyl)butanamide;61445-60-1;SCHEMBL2850348;DTXSID50443403;AZIJUQJAJIZXFC-UHFFFAOYSA-N

Chemical Property of 4-(4-Nitrophenyl)butanamide

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 208.08479225
• Heavy Atom Count: 15
• Complexity: 229

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CCCC(=O)N)[N+](=O)[O-]

Technology Process of 4-(4-Nitrophenyl)butanamide

There total 3 articles about 4-(4-Nitrophenyl)butanamide 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:

4-(4-nitrophenyl)butanoic acid (5600-62-4) → 4-(4-nitro-phenyl)-butyric acid amide (61445-60-1)

Guidance literature:

With phosphorus pentachloride; benzene; anschliessend Behandeln mit wss. NH₃;

DOI:10.1039/jr9570002706

Reference yield:

4-(4-nitrophenyl)butanoyl chloride (5600-63-5) → 4-(4-nitro-phenyl)-butyric acid amide (61445-60-1)

Guidance literature:

With ammonium hydroxide; In dichloromethane; for 1h; Ambient temperature;

DOI:10.1021/jm9707840

Reference yield:

→ 4-(4-nitro-phenyl)-butyric acid amide (61445-60-1)

Guidance literature:

DOI:10.1021/bi00616a009

upstream raw materials:

4-(4-nitrophenyl)butanoic acid

4-(4-nitrophenyl)butanoyl chloride

Downstream raw materials:

4-(4-nitro-phenyl)-butyronitrile

4-(4-nitrophenyl)butylamine

4-(4-aminobutyl)aniline

4-(4-((2-cyanopropan-2-yl)amino)phenyl)butanenitrile