1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

Base Information

Chemical Name:1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone
CAS No.:286474-64-4
Molecular Formula:C₁₂H₁₂ClN₃O
Molecular Weight:249.7
Hs Code.:
DSSTox Substance ID:DTXSID301167907

Synonyms:DTXSID301167907;1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone;286474-64-4

Suppliers and Price of 1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

Supply Marketing:

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

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Chemical Property of 1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:249.0668897
Heavy Atom Count:17
Complexity:287

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=NN(N=C1CC(=O)C)C2=CC(=CC=C2)Cl

Technology Process of 1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

There total 1 articles about 1-[2-(3-Chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone 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: 75.0%

: N-(3-chloro-phenyl)-N'-[1-(5-methyl-isoxazol-3-yl)-ethylidene]-hydrazine

: 286474-64-4
1-[2-(3-chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

Guidance literature:: at 240 ℃;
DOI:10.1002/jhet.5570370221

Reference yield: 50.0%

: 286474-64-4
1-[2-(3-chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

: 286474-68-8
1-[2-(3-chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-1-hydroxyimino-2-propanone

Guidance literature:: With sodium; isopentyl nitrite; In ethanol; for 6h;
DOI:10.1002/jhet.5570370221

Reference yield:

: 286474-64-4
1-[2-(3-chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]-2-propanone

: 3-methyl 2-[2-(3-chlorophenyl)-5-methyl-2H-1,2,3-triazol-4-yl]quinoxaline

Guidance literature:: Multi-step reaction with 2 steps

1: 50 percent / isoamyl nitrite; Na / ethanol / 6 h

2: 48 percent / conc. aq. HCl / methanol / 60 h / Heating

With hydrogenchloride; sodium; isopentyl nitrite; In methanol; ethanol; 1: Nitration / 2: cyclocondensation;
DOI:10.1002/jhet.5570370221