1-Benzyl-2-ethylimidazole

Base Information

• Chemical Name: 1-Benzyl-2-ethylimidazole
• CAS No.: 39269-64-2
• Molecular Formula: C12H14N2
• Molecular Weight: 186.257
• DSSTox Substance ID: DTXSID10381418
• Nikkaji Number: J139.700A
• Wikidata: Q82172215
• Mol file: 39269-64-2.mol

Synonyms:1-benzyl-2-ethylimidazole;1-benzyl-2-ethyl-1H-imidazole;39269-64-2;1H-Imidazole, 2-ethyl-1-(phenylmethyl)-;SCHEMBL156000;DTXSID10381418;MFCD00831051;AKOS009159444

Chemical Property of 1-Benzyl-2-ethylimidazole

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 186.115698455
• Heavy Atom Count: 14
• Complexity: 164

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=NC=CN1CC2=CC=CC=C2

Technology Process of 1-Benzyl-2-ethylimidazole

There total 1 articles about 1-Benzyl-2-ethylimidazole 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%

2-Ethylimidazole (1072-62-4) + benzyl chloride (100-44-7) → 1-benzyl-2-ethyl-1H-imidazole (39269-64-2)

Guidance literature:

2-Ethylimidazole; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at -15 ℃; for 0.5h; Inert atmosphere;

benzyl chloride; In N,N-dimethyl-formamide; mineral oil; at -15 - -5 ℃; for 3h; Inert atmosphere;

DOI:10.1039/c4ra01240b

Reference yield: 91.0%

1-bromo-butane (109-65-9) + 1-benzyl-2-ethyl-1H-imidazole (39269-64-2) → C16H23N2(1+)*Br(1-) (1620123-03-6)

Guidance literature:

In tetrahydrofuran; for 6h; Heating;

DOI:10.1039/c4ra01240b

Reference yield: 90.0%

1-bromo-octane (111-83-1) + 1-benzyl-2-ethyl-1H-imidazole (39269-64-2) → C20H31N2(1+)*Br(1-) (1620123-04-7)

Guidance literature:

In tetrahydrofuran; for 6h; Heating;

DOI:10.1039/c4ra01240b

upstream raw materials:

2-Ethylimidazole

benzyl chloride

Downstream raw materials:

C₁₆H₂₃N₂⁽¹⁺⁾*Br^(1-)

C₂₀H₃₁N₂⁽¹⁺⁾*Br^(1-)

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