1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)ethanone

Base Information

Chemical Name:1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)ethanone
CAS No.:89991-23-1
Molecular Formula:C13H11BrN2OS
Molecular Weight:323.213
Hs Code.:
DSSTox Substance ID:DTXSID30523676
Wikidata:Q82389933

Synonyms:89991-23-1;1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)ethanone;1-(4-Bromophenyl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]ethan-1-one;DTXSID30523676;1-(4-bromophenyl)-2-(6-methylpyrimidin-4-yl)sulfanylethanone;MFCD10480161;AKOS001527608;CCG-152033

Suppliers and Price of 1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)ethanone

Supply Marketing:

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

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Chemical Property of 1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)ethanone

Chemical Property:

XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:321.97755
Heavy Atom Count:18
Complexity:282

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=NC=N1)SCC(=O)C2=CC=C(C=C2)Br

Technology Process of 1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)ethanone

There total 2 articles about 1-(4-Bromophenyl)-2-((6-methylpyrimidin-4-yl)thio)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: 75.0%

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

: 99-73-0,132309-76-3
para-bromophenacyl bromide

: 89991-23-1
1-(4-Bromo-phenyl)-2-(6-methyl-pyrimidin-4-ylsulfanyl)-ethanone

Guidance literature:: With sodium hydroxide; In ethanol; for 6h;
DOI:10.1016/S0040-4020(01)91330-4

Reference yield:

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

: 89991-23-1
1-(4-Bromo-phenyl)-2-(6-methyl-pyrimidin-4-ylsulfanyl)-ethanone

Guidance literature:: Multi-step reaction with 2 steps

1: P₂S₅ / xylene

2: 75 percent / 2percent NaOH aq / ethanol / 6 h

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