2-((6-Methylpyrimidin-4-yl)thio)cyclohexanone

Base Information

Chemical Name:2-((6-Methylpyrimidin-4-yl)thio)cyclohexanone
CAS No.:89991-27-5
Molecular Formula:C₁₁H₁₄N₂OS
Molecular Weight:222.311
Hs Code.:
DSSTox Substance ID:DTXSID40523682

Synonyms:89991-27-5;2-((6-methylpyrimidin-4-yl)thio)cyclohexanone;JOFUSALSRZHGDE-UHFFFAOYSA-;DTXSID40523682;2-[(6-Methylpyrimidin-4-yl)sulfanyl]cyclohexan-1-one;InChI=1/C11H14N2OS/c1-8-6-11(13-7-12-8)15-10-5-3-2-4-9(10)14/h6-7,10H,2-5H2,1H3

Suppliers and Price of 2-((6-Methylpyrimidin-4-yl)thio)cyclohexanone

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

Total 0 raw suppliers

Chemical Property of 2-((6-Methylpyrimidin-4-yl)thio)cyclohexanone

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:222.08268425
Heavy Atom Count:15
Complexity:235

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=NC=N1)SC2CCCCC2=O

Technology Process of 2-((6-Methylpyrimidin-4-yl)thio)cyclohexanone

There total 2 articles about 2-((6-Methylpyrimidin-4-yl)thio)cyclohexanone 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: 50.0%

: 51793-97-6
6-methylpyrimidine-4(3H)-thione

: 822-87-7
2-Chlorocyclohexanone

: 89991-27-5
2-(6-methyl-4-pyrimidinylthio)-cyclohexanone

Guidance literature:: With ethanol; sodium; In N,N-dimethyl-formamide;
DOI:10.1016/S0040-4020(01)91330-4

Reference yield:

: 3524-87-6,156647-95-9
6-methyl-3H-pyrimidin-4-one

: 89991-27-5
2-(6-methyl-4-pyrimidinylthio)-cyclohexanone

Guidance literature:: Multi-step reaction with 2 steps

1: P₂S₅ / xylene

2: 50 percent / Na metal, ethanol / dimethylformamide

With tetraphosphorus decasulfide; ethanol; sodium; In N,N-dimethyl-formamide; xylene;
DOI:10.1016/S0040-4020(01)91330-4