3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine

Base Information

• Chemical Name: 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine
• CAS No.: 252340-70-8
• Molecular Formula: C10H10FN3
• Molecular Weight: 191.208
• Hs Code.: 2933299090
• Mol file: 252340-70-8.mol

Synonyms:[3-Fluoro-4-(4-methylimidazol-1-yl)phenyl]amine;3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)aniline;3-Fluoro-4-(4-methyl-imidazol-1-yl)-phenylamine;

Chemical Property of 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.608
• Boiling Point: 371.077 °C at 760 mmHg
• PKA: 6.16±0.61(Predicted)
• Flash Point: 178.221 °C
• PSA: 43.84000
• Density: 1.268 g/cm³
• LogP: 2.48320
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine

There total 2 articles about 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine 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: 100.0%

3-fluoro-4-(4-methyl-imidazol-1-yl)nitrobenzene (252337-29-4) → 5-Amino-2-(4-methyl-imidazol-1-yl)fluorobenzene (252340-70-8)

Guidance literature:

With thiophene; 10% Pd/C; hydrogen; In methanol; di-isopropyl ether; at 25 ℃;

DOI:10.1021/jm201710f

Reference yield:

3,4-difluoronitrobenzene (369-34-6) → 5-Amino-2-(4-methyl-imidazol-1-yl)fluorobenzene (252340-70-8)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide / 20 h / 120 °C / Inert atmosphere

2: hydrogen / methanol / 12 h / 20 °C

With hydrogen; potassium carbonate; In methanol; N,N-dimethyl-formamide;

Reference yield: 100.0%

5-Amino-2-(4-methyl-imidazol-1-yl)fluorobenzene (252340-70-8) + Benzoyl isothiocyanate (532-55-8) → [3-fluoro-4-(4-methyl-imidazol-1-yl)-phenyl]-thiourea (1172637-86-3)

Guidance literature:

5-Amino-2-(4-methyl-imidazol-1-yl)fluorobenzene; Benzoyl isothiocyanate; In tetrahydrofuran; at 20 ℃; for 2h;

With water; potassium carbonate; In methanol; at 20 ℃;

upstream raw materials:

3-fluoro-4-(4-methyl-imidazol-1-yl)nitrobenzene

3,4-difluoronitrobenzene

Downstream raw materials:

5-Benzyloxycarbonylamino-2-(4-methyl-imidazol-1-yl)fluorobenzene

N-[3-fluoro-4-(4-methyl-imidazol-1-yl)-phenyl]-guanidine nitrate

[3-fluoro-4-(4-methyl-imidazol-1-yl)-phenyl]-thiourea

N-[3-fluoro-4-(4-methyl-1H-imidazol-1-yl)phenyl]-2-(4-fluorophenyl)-3,5-dimethyl-3H-imidazo[4,5-b]pyridin-7-amine

Refernces

• 1、 -. "FUSED MORPHOLINOPYRIMIDINES AND METHODS OF USE THEREOF". Paragraph 0309. . Retrieved 2015/05/19.
• 2、 Bischoff, Francois,Berthelot, Didier,De Cleyn, Michel,MacDonald, Gregor,Minne, Garrett,Oehlrich, Daniel,Pieters, Serge,Surkyn, Michel,Trabanco, Andres A.,Tresadern, Gary,Van Brandt, Sven,Velter, Ingrid,Zaja, Mirko,Borghys, Herman,Masungi, Chantal,Mercken, Marc,Gijsen, Harrie J. M.. "Design and Synthesis of a Novel Series of Bicyclic Heterocycles As Potent γ-Secretase Modulators". . p. 9089 - 9106,18. Retrieved 2020/10/15.