1-Phenyl-2-[bis(methylthio)methylene]-1,3-butanedione

Base Information

Chemical Name:1-Phenyl-2-[bis(methylthio)methylene]-1,3-butanedione
CAS No.:29866-41-9
Molecular Formula:C13H14O2S2
Molecular Weight:266.385
Hs Code.:
DSSTox Substance ID:DTXSID80351744
Nikkaji Number:J2.003.615J
Mol file:29866-41-9.mol

Synonyms:ST036853;29866-41-9;SCHEMBL11455726;DTXSID80351744;AKOS016034316

Suppliers and Price of 1-Phenyl-2-[bis(methylthio)methylene]-1,3-butanedione

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
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Total 0 raw suppliers

Chemical Property of 1-Phenyl-2-[bis(methylthio)methylene]-1,3-butanedione

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:266.04352203
Heavy Atom Count:17
Complexity:322

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C(=C(SC)SC)C(=O)C1=CC=CC=C1

Technology Process of 1-Phenyl-2-[bis(methylthio)methylene]-1,3-butanedione

There total 3 articles about 1-Phenyl-2-[bis(methylthio)methylene]-1,3-butanedione 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:

: 75-15-0,12122-00-8
carbon disulfide

: 93-91-4
1-phenylbutan-1,3-dione

: 74-88-4
methyl iodide

: 29866-41-9
2-(bis(methylthio)methylene)-1-phenylbutane-1,3-dione

Guidance literature:: Multistep reaction; (i) aq. NaOH, HSO4, (ii) /BRN= 969135/;
DOI:10.1016/S0040-4020(01)97222-9

Reference yield:

: 75-15-0,12122-00-8
carbon disulfide

: 93-91-4
1-phenylbutan-1,3-dione

: 29866-41-9
2-(bis(methylthio)methylene)-1-phenylbutane-1,3-dione

Guidance literature:: carbon disulfide; 1-phenylbutan-1,3-dione; With tetrabutylammomium bromide; potassium carbonate; In water; at 20 ℃; for 1h;

Me-X, X = Hal; In water; at 20 ℃; for 8.25h; Further stages.;
DOI:10.1021/jo801406p