2-Fluoro-4-(1-methylimidazol-2-yl)aniline

Base Information

Chemical Name:2-Fluoro-4-(1-methylimidazol-2-yl)aniline
CAS No.:218301-90-7
Molecular Formula:C10H10FN3
Molecular Weight:191.208
Hs Code.:
DSSTox Substance ID:DTXSID80473495
Wikidata:Q82302925
Mol file:218301-90-7.mol

Synonyms:2-fluoro-4-(1-methylimidazol-2-yl)aniline;218301-90-7;2-fluoro-4-(1-methyl-1h-imidazol-2-yl)aniline;SCHEMBL1449897;Benzenamine, 2-fluoro-4-(1-methyl-1H-imidazol-2-yl)-;DTXSID80473495;2-Fluoro-4-(1-methylimidazol-2-;AKOS013290266

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Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-Fluoro-4-(1-methylimidazol-2-yl)aniline

Chemical Property:

XLogP3:1.1
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:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1C=CN=C1C2=CC(=C(C=C2)N)F

Technology Process of 2-Fluoro-4-(1-methylimidazol-2-yl)aniline

There total 3 articles about 2-Fluoro-4-(1-methylimidazol-2-yl)aniline 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: 83.0%

: 218301-89-4
2-fluoro-4-(1'-methylimidazol-2'-yl)-1-tert-butoxycarbonylaniline

: 218301-90-7
2-fluoro-4-(1-methylimidazol-2-yl)aniline

Guidance literature:: With hydrogenchloride; In ethyl acetate; at 20 ℃; for 0.5h;
DOI:10.1021/jm0497949

Reference yield:

: 209958-42-9
tert-butyl N-(4-bromo-2-fluorophenyl)carbamate

: 218301-90-7
2-fluoro-4-(1-methylimidazol-2-yl)aniline

Guidance literature:: Multi-step reaction with 2 steps

1.1: n-BuLi / tetrahydrofuran / 0.5 h / -78 °C

1.2: Bu₃SnCl / tetrahydrofuran / 18 h / -78 - 20 °C

1.3: 60 percent / Pd(PPh₃)4 / tetrahydrofuran / 18 h / Heating

2.1: 83 percent / aq. HCl / ethyl acetate / 0.5 h / 20 °C

With hydrogenchloride; n-butyllithium; In tetrahydrofuran; ethyl acetate;
DOI:10.1021/jm0497949

Reference yield:

: 367-24-8
4-bromo-2-fluoroaniline

: 218301-90-7
2-fluoro-4-(1-methylimidazol-2-yl)aniline

Guidance literature:: Multi-step reaction with 3 steps

1.1: LiN(TMS)2 / tetrahydrofuran / 0 - 20 °C

1.2: 95 percent / tetrahydrofuran / 0.25 h / 20 °C

2.1: n-BuLi / tetrahydrofuran / 0.5 h / -78 °C

2.2: Bu₃SnCl / tetrahydrofuran / 18 h / -78 - 20 °C

2.3: 60 percent / Pd(PPh₃)4 / tetrahydrofuran / 18 h / Heating

3.1: 83 percent / aq. HCl / ethyl acetate / 0.5 h / 20 °C

With hydrogenchloride; n-butyllithium; lithium hexamethyldisilazane; In tetrahydrofuran; ethyl acetate;
DOI:10.1021/jm0497949