Bis((1H-benzo[d]imidazol-2-yl)methyl)amine

Base Information

• Chemical Name: Bis((1H-benzo[d]imidazol-2-yl)methyl)amine
• CAS No.: 89505-04-4
• Molecular Formula: C16H15N5
• Molecular Weight: 277.329
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID60413930
• Nikkaji Number: J881.419H
• Mol file: 89505-04-4.mol

Synonyms:Bis((1H-benzo[d]imidazol-2-yl)methyl)amine;89505-04-4;1-(1H-benzimidazol-2-yl)-N-(1H-benzimidazol-2-ylmethyl)methanamine;SCHEMBL711507;DTXSID60413930;n,n-bis(benzimidazol-2-ylmethyl)amine;bis[(1H-1,3-benzodiazol-2-yl)methyl]amine

Chemical Property of Bis((1H-benzo[d]imidazol-2-yl)methyl)amine

Chemical Property:

• Melting Point: 249-251 °C(Solv: water (7732-18-5); acetone (67-64-1))
• Boiling Point: 630.2±40.0 °C(Predicted)
• PKA: 11.35±0.10(Predicted)
• PSA: 69.39000
• Density: 1.365±0.06 g/cm3(Predicted)
• LogP: 3.11990
• Storage Temp.: 2-8°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 277.13274550
• Heavy Atom Count: 21
• Complexity: 318

Purity/Quality:

98% ^*data from raw suppliers

Bis((1H-benzo[d]imidazol-2-yl)methyl)amine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)NC(=N2)CNCC3=NC4=CC=CC=C4N3

Technology Process of Bis((1H-benzo[d]imidazol-2-yl)methyl)amine

There total 3 articles about Bis((1H-benzo[d]imidazol-2-yl)methyl)amine 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: 90.0%

1,2-diamino-benzene (95-54-5) + iminodiacetic acid (142-73-4) → bis(benzimidazol-2-ylmethyl)amine (89505-04-4)

Guidance literature:

In ethylene glycol; at 180 ℃; for 4h;

DOI:10.1039/c0dt00402b

Reference yield: 42.0%

1,2-diamino-benzene (95-54-5) + iminodiacetic acid (142-73-4) → 2‐((1H‐benzimidazol‐2‐yl)methylamino)acetic acid (99056-03-8) + bis(benzimidazol-2-ylmethyl)amine (89505-04-4)

Guidance literature:

1,2-diamino-benzene; iminodiacetic acid; With hydrogenchloride; In water; at 100 ℃; for 16h;

1,2-diamino-benzene; With hydrogenchloride; In water; for 72h;

DOI:10.1007/s12039-017-1330-2

Reference yield:

→ bis(benzimidazol-2-ylmethyl)amine (89505-04-4)

Guidance literature:

upstream raw materials:

1,2-diamino-benzene

iminodiacetic acid