1-(Ethoxymethyl)-2-phenylimidazole

Base Information

• Chemical Name: 1-(Ethoxymethyl)-2-phenylimidazole
• CAS No.: 86119-53-1
• Molecular Formula: C12H14N2O
• Molecular Weight: 202.25200
• DSSTox Substance ID: DTXSID50516328
• Wikidata: Q82377707

Synonyms:1-(ethoxymethyl)-2-phenylimidazole;86119-53-1;DTXSID50516328;1-ETHOXYMETHYL-2-PHENYLIMIDAZOLE;1-(Ethoxymethyl)-2-phenyl-1H-imidazole

Chemical Property of 1-(Ethoxymethyl)-2-phenylimidazole

Chemical Property:

• PSA: 27.05000
• LogP: 2.54410
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 202.110613074
• Heavy Atom Count: 15
• Complexity: 181

Purity/Quality:

1-(ethoxymethyl)-2-phenyl-1H-Imidazole 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOCN1C=CN=C1C2=CC=CC=C2

Technology Process of 1-(Ethoxymethyl)-2-phenylimidazole

There total 2 articles about 1-(Ethoxymethyl)-2-phenylimidazole 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: 75.0%

2-Phenylimidazole (670-96-2) + ethyl chloromethyl ether (3188-13-4) → 1-(ethoxymethyl)-2-phenyl-1H-imidazole (86119-53-1)

Guidance literature:

With sodium hydride; In tetrahydrofuran; mineral oil; at 20 ℃; for 3h;

DOI:10.1021/acs.joc.5b02592

Reference yield:

1-phenyl-1H-pyrazole (670-96-2) + ethyl chloromethyl ether (3188-13-4) → 1-(ethoxymethyl)-2-phenyl-1H-imidazole (86119-53-1)

Guidance literature:

With sodium hydride; In tetrahydrofuran;

DOI:10.1021/ja00354a025

Reference yield: 92.0%

1-(ethoxymethyl)-2-phenyl-1H-imidazole (86119-53-1) + Diethyl carbonate (105-58-8,76619-83-5) → tris(N-(ethoxymethyl)-2-phenyl-5-imidazolyl)carbinol (86119-41-7)

Guidance literature:

With n-butyllithium; In tetrahydrofuran; hexane; for 2h; -70 deg C -> RT;

DOI:10.1021/ja00354a025

upstream raw materials:

2-Phenylimidazole

ethyl chloromethyl ether

1-phenyl-1H-pyrazole

Downstream raw materials:

N-(ethoxymethyl)-2-phenyl-5-(hydroxymethyl)imidazole

1-(ethoxymethyl)-2-phenyl-5-(trimethylsilyl)-1H-imidazole

bis(N-(ethoxymethyl)-2-phenyl-5-imidazolyl)carbinol

N-(ethoxymethyl)-2-phenyl-5-carbethoxyimidazole

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