3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine

Base Information

• Chemical Name: 3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine
• CAS No.: 106259-87-4
• Molecular Formula: C10H8 Cl3 N3
• Molecular Weight: 276.553
• Hs Code.: 2933199090
• European Community (EC) Number: 670-619-4
• DSSTox Substance ID: DTXSID80366131
• Wikidata: Q82151229
• Mol file: 106259-87-4.mol

Synonyms:106259-87-4;3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine;5-methyl-2-(2,4,6-trichlorophenyl)pyrazol-3-amine;5-Methyl-2-(2,4,6-trichlorophenyl)-2H-pyrazol-3-yl amine;5-methyl-2-(2,4,6-trichlorophenyl)-2h-pyrazol-3-ylamine;3-amino-2-(2,4,6-trichlorophenyl)-5-methylpyrazole;1H-Pyrazol-5-amine,3-methyl-1-(2,4,6-trichlorophenyl)-;SCHEMBL5826687;DTXSID80366131;ABLOGSPAFQBNMG-UHFFFAOYSA-N;AKOS001047414;FS-6349;CS-0339539;FT-0614916;F79930;A801401;SR-01000041870;J-001553;SR-01000041870-1;5-amino-3-methyl-1-(2,4,6-trichlorophenyl)pyrazole;Z55148834

Chemical Property of 3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine

Chemical Property:

• Vapor Pressure: 3.1E-07mmHg at 25°C
• Refractive Index: 1.674
• Boiling Point: 419.2°C at 760 mmHg
• PKA: 2.72±0.10(Predicted)
• Flash Point: 207.3°C
• PSA: 43.84000
• Density: 1.57g/cm³
• LogP: 4.30430
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 274.978380
• Heavy Atom Count: 16
• Complexity: 242

Purity/Quality:

97% ^*data from raw suppliers

3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NN(C(=C1)N)C2=C(C=C(C=C2Cl)Cl)Cl

Technology Process of 3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine

There total 2 articles about 3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine 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:

5-methylisoxazole (5765-44-6) + (2,4,6-trichlorophenyl)hydrazine (5329-12-4) → 5-amino-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazole (106259-87-4)

Guidance literature:

With sodium; In methanol;

Reference yield:

ethyl 5-amino-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazol-4-ylcarboxylate (106259-88-5) → 5-amino-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazole (106259-87-4)

Guidance literature:

In water; isopropyl alcohol;

Reference yield:

5-amino-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazole (106259-87-4) + [1-(4-Dimethylamino-phenyl)-meth-(E)-ylidene]-(5-methyl-2-phenyl-2H-pyrazol-3-yl)-amine (102769-77-7) → 1-Phenyl-3-methyl-5-aminopyrazole (1131-18-6) + 5-(4-N,N-Dimethylaminobenzyliden-amino)-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazol + {4-[3,5-Dimethyl-1,7-bis-(2,4,6-trichloro-phenyl)-1,7-dihydro-dipyrazolo[3,4-b;4',3'-e]pyridin-4-yl]-phenyl}-dimethyl-amine (130627-01-9)

Guidance literature:

In xylene; for 3h; Title compound not separated from byproducts; Heating;

upstream raw materials:

5-methylisoxazole

(2,4,6-trichlorophenyl)hydrazine

ethyl 5-amino-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazol-4-ylcarboxylate

Downstream raw materials:

1-Phenyl-3-methyl-5-aminopyrazole

{4-[3,5-Dimethyl-1,7-bis-(2,4,6-trichloro-phenyl)-1,7-dihydro-dipyrazolo[3,4-b;4',3'-e]pyridin-4-yl]-phenyl}-dimethyl-amine

5-amino-4-dichlorofluoromethylsulphenyl-3-methyl-1-(2,4,6-trichlorophenyl)-pyrazole

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