1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one

Base Information

Chemical Name:1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one
CAS No.:94127-79-4
Molecular Formula:C₁₁H₁₁N₃O
Molecular Weight:201.228
Hs Code.:
DSSTox Substance ID:DTXSID30538649

Synonyms:94127-79-4;1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one;DTXSID30538649

Suppliers and Price of 1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one

Supply Marketing:

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

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Chemical Property of 1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one

Chemical Property:

XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:201.090211983
Heavy Atom Count:15
Complexity:226

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C(C1=CC=CC=C1)N2C=NC=N2

Technology Process of 1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one

There total 1 articles about 1-Phenyl-1-(1H-1,2,4-triazol-1-yl)propan-2-one 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: 83.0%

: 288-88-0
1,2,4-Triazole

: 4773-35-7
1-chloro-1-phenylpropan-2-one

: 94127-79-4
1-Phenyl-1-(1H-1,2,4-triazol-1-yl)-2-propanon

Guidance literature:: With potassium carbonate; In acetonitrile; for 0.25h; Heating;

Reference yield: 27.0%

: 105459-84-5
2,4-dichlorophenyl magnesium iodide

: 94127-79-4
1-Phenyl-1-(1H-1,2,4-triazol-1-yl)-2-propanon

: 106836-87-7
(2R,3R/2S,3S)-2-(2,4-Dichlorphenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-yl)-2-propanol

Guidance literature:: In diethyl ether; for 2h; Heating;

Reference yield:

: 94127-79-4
1-Phenyl-1-(1H-1,2,4-triazol-1-yl)-2-propanon

: 94154-43-5
4-(1-Naphthyl)-3-phenyl-3-(1H-1,2,4-triazol-1-yl)-2-butanol

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaH / 1.) DMF, white oil; 2.) DMF, white oil, 80 deg C, 4 h

2: 88 percent / NaBH₄ / methanol / 1 h / Heating

With sodium tetrahydroborate; sodium hydride; In methanol;