3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-one

Base Information

Chemical Name:3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-one
CAS No.:107383-65-3
Molecular Formula:C12H11NOS
Molecular Weight:217.291
Hs Code.:
DSSTox Substance ID:DTXSID80552734
Wikidata:Q82433101
Mol file:107383-65-3.mol

Synonyms:107383-65-3;3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-one;DTXSID80552734

Suppliers and Price of 3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-one

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 2 raw suppliers

Chemical Property of 3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-one

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:217.05613515
Heavy Atom Count:15
Complexity:301

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)SC2=CC=CNC2=O

Technology Process of 3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-one

There total 1 articles about 3-[(4-Methylphenyl)sulfanyl]pyridin-2(1H)-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: 91.0%

: 13466-43-8
3-bromopyridin-2(1H)-one

: 106-45-6
para-thiocresol

: 107383-65-3
3-(4-methylbenzenesulfenyl)-2-pyridone

Guidance literature:: With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; N-ethyl-N,N-diisopropylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In 1,4-dioxane; at 120 ℃; for 16h; Inert atmosphere; Schlenk technique;
DOI:10.1002/anie.202016561

Reference yield:

: 107383-65-3
3-(4-methylbenzenesulfenyl)-2-pyridone

: 141667-52-9
methyl <<(tert-butyldimethylsilyl)oxy>methyl>-4β-<(4'-methylbenzenesulfonyl)amino>cyclohexene-1-carboxylate

Guidance literature:: Multi-step reaction with 6 steps

1: 1) lithium hexamethyldisilazide / 1) THF, hexane, 0 deg C, 2) THF, hexane

2: 42 percent / CH₂Cl₂ / 120 h / 90 °C

3: 93 percent / NaBH₄ / CH₂Cl₂; methanol / 0.25 h / 0 °C

4: 95 percent / Et₃N / CH₂Cl₂ / 0.08 h / 0 °C

5: 89 percent / Bu₃Sn, azobisisobutyronitrile / benzene / 2 h / Heating

6: 66 percent / CH₂Cl₂; hexane / 4 h / Ambient temperature

With sodium tetrahydroborate; 2,2'-azobis(isobutyronitrile); triethylamine; lithium hexamethyldisilazane; In methanol; hexane; dichloromethane; benzene;
DOI:10.1021/jo00041a010

Reference yield:

: 107383-65-3
3-(4-methylbenzenesulfenyl)-2-pyridone

: 141667-47-2
4-(4-methylbenzenesulfenyl)-2-(4'-methylbenzenesulfonyl)-3-oxo-2-azabicyclo<2.2.2>oct-7-ene-5-endo-carboxaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 1) lithium hexamethyldisilazide / 1) THF, hexane, 0 deg C, 2) THF, hexane

2: 42 percent / CH₂Cl₂ / 120 h / 90 °C

With lithium hexamethyldisilazane; In dichloromethane;
DOI:10.1021/jo00041a010