Benzenamine, 3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)-

Base Information

• Chemical Name: Benzenamine, 3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)-
• CAS No.: 591232-29-0
• Molecular Formula: C9H9FN4
• Molecular Weight: 192.196
• Mol file: 591232-29-0.mol

Synonyms:3-fluoro-4-(3-methyl-1,2,4-triazol-1-yl)phenylamine;3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)aniline;

Chemical Property of Benzenamine, 3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)-

Chemical Property:

• PSA: 56.73000
• LogP: 1.87820

Purity/Quality:

3-Fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)aniline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzenamine, 3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)-

There total 2 articles about Benzenamine, 3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)- 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: 99.0%

1-(2-Fluoro-4-nitro-phenyl)-3-methyl-1H-[1,2,4]triazole → 3-fluoro-4-(3-methyl-[1,2,4]triazol-1-yl)-phenylamine (591232-29-0)

Guidance literature:

With thiophene; hydrogen; palladium 10% on activated carbon; In methanol; di-isopropyl ether; at 50 ℃;

Reference yield:

3,4-difluoronitrobenzene (369-34-6) → 3-fluoro-4-(3-methyl-[1,2,4]triazol-1-yl)-phenylamine (591232-29-0)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydrogencarbonate / dimethyl sulfoxide / 48 h / 80 °C

2: hydrogen / palladium 10% on activated carbon / methanol / 78 h / 20 °C / Cooling with ice-water

With hydrogen; sodium hydrogencarbonate; palladium 10% on activated carbon; In methanol; dimethyl sulfoxide;

Reference yield: 68.0%

3-fluoro-4-(3-methyl-[1,2,4]triazol-1-yl)-phenylamine (591232-29-0) + 4-benzyl-2-chloro-6-methyl-pyrimidine (861031-86-9) → (4-benzyl-6-methyl-pyrimidin-2-yl)-[3-fluoro-4-(3-methyl-[1,2,4]-triazol-1-yl)-phenyl]-amine (1185017-65-5)

Guidance literature:

With potassium carbonate; palladium diacetate; CyJohnPhos; In 1,4-dioxane; ISOPROPYLAMIDE; at 200 ℃; for 0.333333h; Inert atmosphere; Microwave irradiation;

upstream raw materials:

3,4-difluoronitrobenzene

Downstream raw materials:

(4-benzyl-6-methyl-pyrimidin-2-yl)-[3-fluoro-4-(3-methyl-[1,2,4]-triazol-1-yl)-phenyl]-amine

N₄-ethyl-N₂-(3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)phenyl)-8-phenyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-diamine

1-(4-ethylamino-2-(3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)phenylamino)-8-phenyl-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)-2,2,2-trifluoroethanone

N₄-ethyl-N₂-(3-fluoro-4-(3-methyl-1H-1,2,4-triazol-1-yl)phenyl)-6-(4-methoxybenzyl)-8-phenyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-diamine