2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide

Base Information

• Chemical Name: 2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide
• CAS No.: 17714-02-2
• Molecular Formula: C15H12ClN3O4
• Molecular Weight: 333.72600
• DSSTox Substance ID: DTXSID10388568
• Nikkaji Number: J365.317J
• Wikidata: Q82183624
• Mol file: 17714-02-2.mol

Synonyms:17714-02-2;2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide;Acetamide, 2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]-;AC1MIEHR;2-amino-n-(2-(2-chlorobenzoyl)-4-nitrophenyl)acetamide;(Clonazepam Impurity)";DTXSID10388568;2-Amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide(Clonazepam Impurity);2-Amino-2/'-(o-chlorobenzoyl)-4/'-nitroacetanilide

Chemical Property of 2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide

Chemical Property:

• Melting Point: >238°C (dec.)
• Boiling Point: 616.7±55.0 °C(Predicted)
• PKA: 11.94±0.70(Predicted)
• PSA: 121.50000
• Density: 1.463±0.06 g/cm3(Predicted)
• LogP: 4.24940
• Storage Temp.: Refrigerator, under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 333.0516336
• Heavy Atom Count: 23
• Complexity: 468

Purity/Quality:

97% ^*data from raw suppliers

2-Amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide(ClonazepamImpurity) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)CN)Cl
• Uses: An impurity of Clonazepam (C587080).

Technology Process of 2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide

There total 1 articles about 2-amino-N-[2-(2-chlorobenzoyl)-4-nitrophenyl]acetamide 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:

→ 2-aminoacetamido-2'-chloro-5-nitrobenzophenone (17714-02-2)

Guidance literature:

2-(α-Bromacetamido)-5-nitro-2'-chlorbenzophenon, NH3;

Reference yield: 94.0%

BOC-glycine (4530-20-5) + 2-aminoacetamido-2'-chloro-5-nitrobenzophenone (17714-02-2) → 2-(N-t-boc-aminoacetylamino-acetylamino)-5-nitro-2'-chlorobenzophenone (101928-16-9)

Guidance literature:

With dicyclohexyl-carbodiimide; In tetrahydrofuran; for 4h; Ambient temperature;

Reference yield: 58.0%

2-aminoacetamido-2'-chloro-5-nitrobenzophenone (17714-02-2) → 3-Amino-4-(2-chlorphenyl)-6-nitro-2(1H)-chinolinon (55198-89-5)

Guidance literature:

With acetic acid; In acetone; for 4h; Heating;

Downstream raw materials:

9b-(2-Chlorphenyl)-2,2-dimethyl-8-nitro-2,3,3a,9b-tetrahydro-5H-oxazolo<4,5-c>chinolin-4-on

2-(N-t-boc-aminoacetylamino-acetylamino)-5-nitro-2'-chlorobenzophenone

3-Amino-4-(2-chlorphenyl)-6-nitro-2(1H)-chinolinon

5-(2-chlorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one