1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol]

Base Information

Chemical Name:1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol]
CAS No.:199391-98-5
Molecular Formula:C₂₈H₂₈Cl₄N₆O₂S₂
Molecular Weight:686.513
Hs Code.:
DSSTox Substance ID:DTXSID60904818

Synonyms:SCHEMBL7525312;DTXSID60904818;1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol];199391-98-5

Suppliers and Price of 1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol]

Supply Marketing:

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

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of 1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol]

Chemical Property:

XLogP3:6.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:13
Exact Mass:686.043977
Heavy Atom Count:42
Complexity:869

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=NC=N3)SSC4=NC=NN4CC(CC5=CC=CC=C5Cl)(C6(CC6)Cl)O)O)Cl

Technology Process of 1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol]

There total 4 articles about 1,1'-[Dithiobis(1H-1,2,4-triazole-5,1-diyl)]bis[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-propanol] 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%

: 3-chloro-2-(1-chloro-cycloprop-1-yl)-1-(2-chloro-phenyl)-propan-2-ol

: 14804-01-4
1,2-di(4H-1,2,4-triazol-3-yl)disulfane

: 199391-98-5
di-{1-[2-(1-chlorocyclopropyl)-3-(2-chloro-phenyl)-2-hydroxy-propyl-1]-1,2,4-triazol-5-yl} disulphide

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 50 ℃; for 2h; Solvent; Temperature;

Reference yield:

: 178928-70-6,303048-98-8,303048-99-9,856220-33-2
prothioconazole

: 199391-98-5
di-{1-[2-(1-chlorocyclopropyl)-3-(2-chloro-phenyl)-2-hydroxy-propyl-1]-1,2,4-triazol-5-yl} disulphide

Guidance literature:: With iodine; In dichloromethane;

Reference yield:

: 120983-72-4
1-chlorocyclopropyl-2-chloro-ethan-1-one

: 199391-98-5
di-{1-[2-(1-chlorocyclopropyl)-3-(2-chloro-phenyl)-2-hydroxy-propyl-1]-1,2,4-triazol-5-yl} disulphide

Guidance literature:: Multi-step reaction with 2 steps

1.1: iodine; magnesium / tetrahydrofuran / 1 h / Cooling with ice

1.2: 1 h / Cooling with ice

2.1: potassium carbonate / N,N-dimethyl-formamide / 2 h / 50 °C

With iodine; potassium carbonate; magnesium; In tetrahydrofuran; N,N-dimethyl-formamide;