Benzamide, N-acetyl-4-chloro-

Base Information

• Chemical Name: Benzamide, N-acetyl-4-chloro-
• CAS No.: 30334-17-9
• Molecular Formula: C9H8ClNO2
• Molecular Weight: 197.621
• DSSTox Substance ID: DTXSID40471316
• Nikkaji Number: J1.754.678C
• Wikidata: Q82299804
• Mol file: 30334-17-9.mol

Synonyms:Benzamide, N-acetyl-4-chloro-;N-acetyl-4-chlorobenzamide;N-acetyl-4-chloro-benzamide;30334-17-9;N-Acetyl-4-chlorbenzamid;SCHEMBL13273458;DTXSID40471316

Chemical Property of Benzamide, N-acetyl-4-chloro-

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 197.0243562
• Heavy Atom Count: 13
• Complexity: 210

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)NC(=O)C1=CC=C(C=C1)Cl

Technology Process of Benzamide, N-acetyl-4-chloro-

There total 22 articles about Benzamide, N-acetyl-4-chloro- 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: 97.0%

acetic anhydride (108-24-7) + 4-chlorobenzamide (619-56-7) → N-acetyl-4-chlorobenzamide (30334-17-9)

Guidance literature:

With sulfuric acid; at 100 ℃; for 0.05h; Microwave irradiation;

DOI:10.1016/j.tet.2012.01.003

Reference yield: 94.0%

4-Cyanochlorobenzene (623-03-0) + acetic anhydride (108-24-7) → N-acetyl-4-chlorobenzamide (30334-17-9)

Guidance literature:

With toluene-4-sulfonic acid; for 0.1h; Sonication; neat (no solvent);

DOI:10.2298/JSC110511168N

Reference yield: 93.0%

N-(4-chlorobenzyl)acetamide (57058-33-0) → N-acetyl-4-chlorobenzamide (30334-17-9)

Guidance literature:

With 2-chloroanthracene-9,10-dione; oxygen; In ethyl acetate; at 20 ℃; for 30h; Irradiation;

DOI:10.1016/j.tetlet.2014.03.123

upstream raw materials:

N-chloro-N'-(4-chloro-benzoyl)-acetamidine

4-chlorobenzoyl azide

acetic anhydride

N-(p-chlorobenzoyl)-L-alanine

Downstream raw materials:

5-(4-chlorophenyl)-3-methyl-1-phenyl-1H-1,2,4-triazole