3-(1H-1,2,4-TRIAZOL-1-YL)ANILINE

Base Information

• Chemical Name: 3-(1H-1,2,4-TRIAZOL-1-YL)ANILINE
• CAS No.: 176032-78-3
• Molecular Formula: C8H8 N4
• Molecular Weight: 160.178
• Hs Code.: 2933990090
• Mol file: 176032-78-3.mol

Synonyms:3-(1,2,4-Triazol-1-yl)aniline;3-(1H-1,2,4-Triazol-1-yl)aniline; 3-([1,2,4]Triazol-1-yl)phenylamine

Chemical Property of 3-(1H-1,2,4-TRIAZOL-1-YL)ANILINE

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 102 °C
• Boiling Point: 394.5°Cat760mmHg
• PKA: 3.44±0.10(Predicted)
• Flash Point: 192.4°C
• PSA: 56.73000
• Density: 1.32g/cm³
• LogP: 1.43070
• Storage Temp.: 2-8°C(protect from light)

Purity/Quality:

98%min ^*data from raw suppliers

3-(1,2,4-Triazol-1-yl)aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R11-20/21/22-36/37/38:
• Hazard Codes: R11-20/21/22-36/37/38:
• Statements: 11-20/21/22-36/37/38
• Safety Statements: 16-26-36/37/39-22

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 3-(1,2,4-Triazol-1-yl)aniline is used in the preparation of N-(pyrimidinylaminophenyl) sulfonamides as ZAP-70 inhibitors.

Technology Process of 3-(1H-1,2,4-TRIAZOL-1-YL)ANILINE

There total 2 articles about 3-(1H-1,2,4-TRIAZOL-1-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: 87.0%

1,2,4-Triazole (288-88-0) + 3-Iodoaniline (626-01-7) → 3-([1,2,4]triazol-1-yl)phenylamine (176032-78-3)

Guidance literature:

With potassium phosphate; copper(l) iodide; 1,10-Phenanthroline; In 1,4-dioxane; at 110 ℃; for 24h; Inert atmosphere;

Reference yield:

→ 3-([1,2,4]triazol-1-yl)phenylamine (176032-78-3)

Guidance literature:

Reference yield: 50.3%

3-([1,2,4]triazol-1-yl)phenylamine (176032-78-3) + 3-methyl-2-trifluoromethyl-1H-indole-7-carboxylic acid → N-[3-(1,2,4-triazol-1-yl)-phenyl]-3-methyl-2-trifluoromethyl-1H-indole-7-carboxamide (333793-18-3)

Guidance literature:

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; dmap; In dichloromethane; at 20 ℃; for 72h;

upstream raw materials:

1,2,4-Triazole

3-Iodoaniline

Downstream raw materials:

N-[3-(1,2,4-triazol-1-yl)-phenyl]-3-methyl-2-trifluoromethyl-1H-indole-7-carboxamide

6-[(cyclopropylmethyl)(propyl)amino]-N-[3-(1H-1,2,4-triazol-1-yl)phenyl]pyrimidine-4-carboxamide

N-[3-(1,2,4-triazol-1-yl)-phenyl]-9H-carbazole-1-carboxamide

2-((3-(1H-1,2,4-triazol-1-yl)phenyl)amino)-1-(1H-indol-3-yl)-2-phenylethanone

Refernces

• 1、 -. "3-AZABICYCLO [3.1.0] HEXANE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS". Page/Page column 43. . Retrieved 2009/08/16.