Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine

Base Information

• Chemical Name: Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine
• CAS No.: 28992-50-9
• Molecular Formula: C13H9N7
• Molecular Weight: 263.26
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID80396377
• Nikkaji Number: J1.531.748E
• Wikidata: Q82197058
• Mol file: 28992-50-9.mol

Synonyms:28992-50-9;Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine;bis(benzotriazol-1-yl)methanimine;di(1H-benzo[d][1,2,3]triazol-1-yl)methanimine;1H-Benzotriazole, 1,1'-carbonimidoylbis-;1,1-di(1H-1,2,3-benzotriazol-1-yl)methanimine;C13H9N7;SCHEMBL2732640;DTXSID80396377;Bis(benzotriazol-1-yl)methylimine;XULYYEAADFGYCX-UHFFFAOYSA-N;BDBM395373;US10308636, Example 60;di(1h-benzotriazol-1-yl)methanimine;MFCD00962329;Bis(1H-benzotriazole-1-yl)methanimine;AB10144;AS-44433;Di(1,2,3-benzotriazol-1-yl)methanimine;CS-0187322;A876562;J-520221;a-1H-Benzotriazol-1-yl-1H-benzotriazole-1-methanimine;1H-Benzotriazole-1-methanimine, alpha-1H-benzotriazol-1-yl-;1-(1H-1,2,3-benzotriazole-1-carboximidoyl)-1H-1,2,3-benzotriazole

Chemical Property of Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine

Chemical Property:

• PSA: 85.27000
• LogP: 1.60690
• Storage Temp.: 2-8°C
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 263.09194332
• Heavy Atom Count: 20
• Complexity: 353

Purity/Quality:

97% ^*data from raw suppliers

Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=NN2C(=N)N3C4=CC=CC=C4N=N3

Technology Process of Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine

There total 7 articles about Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanimine 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: 92.0%

bromocyane (506-68-3) + sodium benzotriazolate (15217-42-2) → 1-cyanobenzotriazole (15328-32-2) + 1,1'-Carbonimidoyldi(benzotriazole) (28992-50-9)

Guidance literature:

In tetrahydrofuran; at 20 ℃; for 1h;

Reference yield: 70.0%

sodium cyanide (143-33-9,25596-52-5) + N-chlorobenzotriazole (21050-95-3) → 1-cyanobenzotriazole (15328-32-2) + 1,1'-Carbonimidoyldi(benzotriazole) (28992-50-9)

Guidance literature:

In acetonitrile; for 24h; Ambient temperature;

DOI:10.1021/jo9717548

Reference yield: 60.0%

1,2,3-Benzotriazole (95-14-7,27556-51-0) + bromocyane (506-68-3) → 1-cyanobenzotriazole (15328-32-2) + 1,1'-Carbonimidoyldi(benzotriazole) (28992-50-9)

Guidance literature:

1,2,3-Benzotriazole; With sodium methylate; In methanol;

bromocyane; In chloroform; at 25 ℃;

upstream raw materials:

sodium cyanide

N-chlorobenzotriazole

bromocyane

sodium benzotriazolate