2-Fluoro-4-(2-methyl-imidazol-1-YL)-phenylamine

Base Information

• Chemical Name: 2-Fluoro-4-(2-methyl-imidazol-1-YL)-phenylamine
• CAS No.: 218301-88-3
• Molecular Formula: C10H10FN3
• Molecular Weight: 191.208
• DSSTox Substance ID: DTXSID00431456
• Wikidata: Q82245341
• Mol file: 218301-88-3.mol

Synonyms:218301-88-3;2-FLUORO-4-(2-METHYL-IMIDAZOL-1-YL)-PHENYLAMINE;2-fluoro-4-(2-methylimidazol-1-yl)aniline;SCHEMBL3830592;DTXSID00431456;AKOS006291332;2-Fluoro-4-(2-methyl-1H-imidazol-1-yl)aniline;J-014310

Chemical Property of 2-Fluoro-4-(2-methyl-imidazol-1-YL)-phenylamine

Chemical Property:

• PSA: 43.84000
• LogP: 2.48320
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 191.08587549
• Heavy Atom Count: 14
• Complexity: 200

Purity/Quality:

97% ^*data from raw suppliers

2-FLUORO-4-(2-METHYL-IMIDAZOL-1-YL)-PHENYLAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=CN1C2=CC(=C(C=C2)N)F

Technology Process of 2-Fluoro-4-(2-methyl-imidazol-1-YL)-phenylamine

There total 3 articles about 2-Fluoro-4-(2-methyl-imidazol-1-YL)-phenylamine 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-methylimidazole (693-98-1) + 2-fluro-4-iodoaniline (29632-74-4) → 2-Fluoro-4-(2-methyl-imidazol-1-yl)-phenylamine (218301-88-3)

Guidance literature:

With 8-quinolinol; potassium carbonate; copper(l) iodide; In dimethyl sulfoxide; at 125 - 130 ℃;

Reference yield: 48.5%

2-methylimidazole (693-98-1) + 4-(tert-butoxycarbonylamino)-3-fluorophenylboronic acid (218301-87-2) → 2-Fluoro-4-(2-methyl-imidazol-1-yl)-phenylamine (218301-88-3)

Guidance literature:

2-methylimidazole; 4-(tert-butoxycarbonylamino)-3-fluorophenylboronic acid; With pyridine; copper diacetate; In tetrahydrofuran; at 20 ℃; for 16h;

With hydrogenchloride; In water; ethyl acetate; at 20 ℃; for 1h;

Reference yield:

C15H18FN3O2 → 2-Fluoro-4-(2-methyl-imidazol-1-yl)-phenylamine (218301-88-3)

Guidance literature:

C₁₅H₁₈FN₃O₂; With hydrogenchloride; In ethyl acetate; at 20 ℃; for 1h;

With sodium hydroxide; In water; pH=8;

upstream raw materials:

2-methylimidazole

2-fluro-4-iodoaniline

4-(tert-butoxycarbonylamino)-3-fluorophenylboronic acid

Downstream raw materials:

1-(3'-aminobenzisoxazol-5'-yl)-3-trifluoromethyl-5-[(4'-(2''-methylimidazol-1''-yl)-2'-fluorophenyl)aminocarbonyl]pyrazole TFA salt

1-(3'-aminobenzisoxazol-5'-yl)-3-ethyl-5-[[4-(2'-methylimidazol-1'-yl)-2-fluorophenyl]aminocarbonyl]pyrazole TFA salt

1-(3'-cyano-4'-fluorophenyl)-3-trifluoromethyl-N-[2-fluoro-4-[(2'-methyl)imidazol-1-yl]phenyl]-1H-pyrazole-5-carboxyamide

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