2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone

Base Information

Chemical Name:2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone
CAS No.:1227958-34-0
Molecular Formula:C7H10ClN3O
Molecular Weight:187.629
Hs Code.:2933990090
Mol file:1227958-34-0.mol

Synonyms:2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone

Suppliers and Price of 2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
2-CHLORO-1-(1-ISOPROPYL-1H-1,2,4-TRIAZOL-5-YL)ETHANONE 95.00%
5MG
$ 501.41

Total 7 raw suppliers

Chemical Property of 2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone

Chemical Property:

Boiling Point:316.1±44.0 °C(Predicted)
PKA:0.58±0.10(Predicted)
PSA：47.78000
Density:1.32±0.1 g/cm3(Predicted)
LogP:1.28050

Purity/Quality:

97% ^*data from raw suppliers

2-CHLORO-1-(1-ISOPROPYL-1H-1,2,4-TRIAZOL-5-YL)ETHANONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Technology Process of 2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone

There total 1 articles about 2-chloro-1-(1-isopropyl-1H-1,2,4-triazol-5-yl)ethanone 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: 31.0%

: 67442-07-3
2-chloro-N-methoxy-N-methylacetamide

: 63936-02-7
1-isopropyl-4,5-dihydro-1H-1,2,4-triazole

: 1227958-34-0
2-chloro-1-(2-isopropyl-2H-[1,2,4]triazol-3-yl)ethanone

Guidance literature:: 1-isopropyl-4,5-dihydro-1H-1,2,4-triazole; With n-butyllithium; In tetrahydrofuran; hexane; at -25 - -5 ℃; for 2h; Inert atmosphere; Large scale;

2-chloro-N-methoxy-N-methylacetamide; In tetrahydrofuran; hexane; at -15 - -10 ℃; for 4h; Inert atmosphere; Large scale;
DOI:10.1016/j.tet.2020.131840

Reference yield: 92.0%

: 1227958-34-0
2-chloro-1-(2-isopropyl-2H-[1,2,4]triazol-3-yl)ethanone

: 4-(benzyloxy)-2-fluorobenzimidamide hydrochloride

: 5-(2-(4-(benzyloxy)-2-fluorophenyl)-1H-imidazole-4-yl)-1-isopropyl-1H-1,2,4-triazole

Guidance literature:: 4-(benzyloxy)-2-fluorobenzimidamide hydrochloride; With potassium hydrogencarbonate; In tetrahydrofuran; water; at 70 ℃; for 0.5h; Inert atmosphere; Large scale;

2-chloro-1-(2-isopropyl-2H-[1,2,4]triazol-3-yl)ethanone; In tetrahydrofuran; water; at 70 ℃; for 13h; Inert atmosphere; Large scale;
DOI:10.1016/j.tet.2020.131840

Reference yield:

: 1227958-34-0
2-chloro-1-(2-isopropyl-2H-[1,2,4]triazol-3-yl)ethanone

: 2-(2-(4-(benzyloxy)-2-fluorophenyl)-4-(1-isopropyl-1H-1,2,4-triazol-5-yl)-1H-imidazole-1-yl)ethanol

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium hydrogencarbonate / tetrahydrofuran; water / Reflux

1.2: 18.67 h / Reflux

2.1: toluene / 7.5 h / 130 °C

With potassium hydrogencarbonate; In tetrahydrofuran; water; toluene;
DOI:10.1021/acs.jmedchem.5b01483