Benzonitrile, 2-amino-3-nitro-

Base Information

• Chemical Name: Benzonitrile, 2-amino-3-nitro-
• CAS No.: 87331-46-2
• Molecular Formula: C7H5 N3 O2
• Molecular Weight: 163.136
• Hs Code.: 2926909090
• Mol file: 87331-46-2.mol

Synonyms:Anthranilonitrile,3-nitro- (6CI)

Chemical Property of Benzonitrile, 2-amino-3-nitro-

Chemical Property:

• PSA: 95.63000
• LogP: 2.15308

Purity/Quality:

98% ^*data from raw suppliers

2-Amino-3-nitrobenzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzonitrile, 2-amino-3-nitro-

There total 4 articles about Benzonitrile, 2-amino-3-nitro- 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: 74.0%

3-nitro-2-chlorobenzonitrile (34662-24-3) → 2-amino-3-nitrobenzonitrile (87331-46-2)

Guidance literature:

With ammonia; In ethanol; at 120 ℃; for 5h; Sealed tube;

DOI:10.1002/jhet.179

Reference yield: 21.0%

3-nitrobenzonitrile (619-24-9) → 5-nitroanthranilonitrile (17420-30-3) + 2-amino-3-nitrobenzonitrile (87331-46-2) + 4-Amino 3-nitro-benzonitrile (6393-40-4)

Guidance literature:

With 2,4,6-trichlorosulfenamide; potassium tert-butylate; In N,N-dimethyl-formamide; at 20 ℃; for 0.333333h;

DOI:10.1021/jo970582b

Reference yield:

2-Chlorobenzonitrile (873-32-5) → 5-nitroanthranilonitrile (17420-30-3) + 2-amino-3-nitrobenzonitrile (87331-46-2)

Guidance literature:

Yield given. Multistep reaction;

upstream raw materials:

3-nitrobenzonitrile

2-Chlorobenzonitrile

3-nitro-2-chlorobenzonitrile

Downstream raw materials:

3-cyano-benzene-1,2-diamine

C₁₆H₁₂N₂O₄

C₁₆H₁₂N₂O₃

C₁₅H₁₀N₂O₃

Refernces

• 1、 Goeker, Hakan,Alp, Mehmet,Ates-Alagoez, Zeynep,Yildiz, Sulhiye. "Synthesis and potent antifungal activity against Candida species of some novel 1H-benzimidazoles". experimental part. p. 936 - 948. Retrieved 2009/12/05.
• 2、 Pagoria, Philip F.,Mitchell, Alexander R.,Schmidt, Robert D.. "1,1,1-trimethylhydrazinium iodide: A novel, highly reactive reagent for aromatic amination via vicarious nucleophilic substitution of hydrogen". . p. 2934 - 2935. Retrieved 2007/10/03.