1-(4-Bromo-2-methoxyphenyl)-4-methyl-1H-imidazole

Base Information

• Chemical Name: 1-(4-Bromo-2-methoxyphenyl)-4-methyl-1H-imidazole
• CAS No.: 870838-56-5
• Molecular Formula: C11H11BrN2O
• Molecular Weight: 267.125
• Hs Code.: 2933290090
• European Community (EC) Number: 807-214-0
• DSSTox Substance ID: DTXSID30697068
• Wikidata: Q82626884
• Mol file: 870838-56-5.mol

Synonyms:1-(4-BROMO-2-METHOXYPHENYL)-4-METHYL-1H-IMIDAZOLE;870838-56-5;1-(4-bromo-2-methoxyphenyl)-4-methylimidazole;SCHEMBL297411;DTXSID30697068;KHGOIOOGUJMLBQ-UHFFFAOYSA-N;VJB83856;MFCD11040217;AKOS016004262;CS-0134044;FT-0723286;3-methoxy-4-(4-methyl-imidazol-1-yl)-phenylbromide;A1-10010;1-(4-bromo-2-methoxy-phenyl)-4-methyl-1H-imidazole

Chemical Property of 1-(4-Bromo-2-methoxyphenyl)-4-methyl-1H-imidazole

Chemical Property:

• PSA: 27.05000
• LogP: 2.95180
• Storage Temp.: 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 266.00548
• Heavy Atom Count: 15
• Complexity: 215

Purity/Quality:

NLT 98% ^*data from raw suppliers

1-(4-Bromo-2-methoxyphenyl)-4-methyl-1H-imidazole >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CN(C=N1)C2=C(C=C(C=C2)Br)OC

Technology Process of 1-(4-Bromo-2-methoxyphenyl)-4-methyl-1H-imidazole

There total 12 articles about 1-(4-Bromo-2-methoxyphenyl)-4-methyl-1H-imidazole 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: 91.3%

3-methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline (958245-18-6) → 1-(4-bromo-2-methoxyphenyl)-4-methyl-1H-imidazole (870838-56-5)

Guidance literature:

3-methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline; With sulfuric acid; acetic acid; sodium nitrite; at 10 - 20 ℃; for 0.5h;

With hydrogen bromide; copper(I) bromide; In water; at 20 ℃; for 1h;

With sodium carbonate; In dichloromethane; water;

Reference yield: 74.0%

[4-bromo-2-(methyloxy)phenyl](2-oxopropyl)formamide (1145786-43-1) → 1-(4-bromo-2-methoxyphenyl)-4-methyl-1H-imidazole (870838-56-5)

Guidance literature:

With ammonium acetate; acetic acid; at 140 ℃; for 1h;

Reference yield: 58.0%

4-methyl-1H-imidazole (822-36-6) + 4-bromo-1-iodo-2-methoxybenzene (791642-68-7) → 1-(4-bromo-2-methoxyphenyl)-4-methyl-1H-imidazole (870838-56-5)

Guidance literature:

With copper(l) iodide; 8-quinolinol; caesium carbonate;

DOI:10.1016/j.bmcl.2011.04.143

upstream raw materials:

N-(4-bromo-2-methoxyphenyl)-N-(2-oxopropyl)acetamide

4-methyl-1H-imidazole

4-bromo-1-iodo-2-methoxybenzene

[4-bromo-2-(methyloxy)phenyl](2-oxopropyl)formamide

Downstream raw materials:

1-(4-iodine-2-methoxyphenyl)-4-methyl-1H-imidazole

[4-(4-methyl-1H-imidazol-1-yl)-3-(methyloxy)phenyl]boronic acid

4-methyl-1-[2-(methyloxy)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-imidazole

N-(3-biphenylylmethyl)-6-[4-(4-methyl-1H-imidazol-1-yl)-3-(methyloxy)phenyl]-3-pyridazinamine