4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile

Base Information

Chemical Name:4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile
CAS No.:429658-96-8
Molecular Formula:C₁₅H₁₂N₄
Molecular Weight:248.287
Hs Code.:
DSSTox Substance ID:DTXSID001217252

Synonyms:4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile;DTXSID001217252;429658-96-8

Suppliers and Price of 4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:248.106196400
Heavy Atom Count:19
Complexity:352

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1CC2=NC3=C(N2)C=C(C=C3)N)C#N

Technology Process of 4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile

There total 4 articles about 4-[(6-amino-1H-benzimidazol-2-yl)methyl]benzonitrile 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:

: 236417-26-8
4-[(5-nitro-1H-benzimidazol-2-yl)-methyl]-benzonitrile

: 429658-96-8
4-(5-amino-1H-benzoimidazol-2-ylmethyl)-benzonitrile

Guidance literature:: With hydrogen; 10percent Pd/C; In methanol; dichloromethane;
DOI:10.1021/jm0109513

Reference yield:

: 5462-71-5
4-cyanophenylacetic acid

: 429658-96-8
4-(5-amino-1H-benzoimidazol-2-ylmethyl)-benzonitrile

Guidance literature:: Multi-step reaction with 3 steps

1.1: CDI / tetrahydrofuran / 50 °C

1.2: tetrahydrofuran / 50 °C

2.1: glacial acetic acid / Heating

3.1: H₂ / 10percent Pd/C / methanol; CH₂Cl₂

With hydrogen; acetic acid; 1,1'-carbonyldiimidazole; 10percent Pd/C; In tetrahydrofuran; methanol; dichloromethane;
DOI:10.1021/jm0109513

Reference yield:

: 99-56-9
4-Nitrophenylene-1,2-diamine

: 429658-96-8
4-(5-amino-1H-benzoimidazol-2-ylmethyl)-benzonitrile

Guidance literature:: Multi-step reaction with 3 steps

1.1: CDI / tetrahydrofuran / 50 °C

1.2: tetrahydrofuran / 50 °C

2.1: glacial acetic acid / Heating

3.1: H₂ / 10percent Pd/C / methanol; CH₂Cl₂

With hydrogen; acetic acid; 1,1'-carbonyldiimidazole; 10percent Pd/C; In tetrahydrofuran; methanol; dichloromethane;
DOI:10.1021/jm0109513