4-Acetyl-3-methylphenyl trifluoromethanesulfonate

Base Information

Chemical Name:4-Acetyl-3-methylphenyl trifluoromethanesulfonate
CAS No.:252561-46-9
Molecular Formula:C10H9F3O4S
Molecular Weight:282.24
Hs Code.:
DSSTox Substance ID:DTXSID30467364
Nikkaji Number:J1.860.116H
Wikidata:Q82294298
Mol file:252561-46-9.mol

Synonyms:4-acetyl-3-methylphenyl trifluoromethanesulfonate;252561-46-9;SCHEMBL1748180;DTXSID30467364;trifluoromethanesulfonic acid 4-acetyl-3-methylphenyl ester;Trifluoro-methanesulfonic acid 4-acetyl-3-methyl-phenyl ester

Suppliers and Price of 4-Acetyl-3-methylphenyl trifluoromethanesulfonate

Supply Marketing:

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

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Chemical Property of 4-Acetyl-3-methylphenyl trifluoromethanesulfonate

Chemical Property:

XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:282.01736442
Heavy Atom Count:18
Complexity:410

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=CC(=C1)OS(=O)(=O)C(F)(F)F)C(=O)C

Technology Process of 4-Acetyl-3-methylphenyl trifluoromethanesulfonate

There total 2 articles about 4-Acetyl-3-methylphenyl trifluoromethanesulfonate 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: 94.0%

: 358-23-6
trifluoromethylsulfonic anhydride

: 875-59-2
4'-hydroxy-2'methylacetophenone

: 252561-46-9
4-acetyl-3-methylphenyl trifluoromethanesulfonate

Guidance literature:: With pyridine; at 0 - 20 ℃;

Reference yield: 18.0%

: 1160637-92-2
4-(1-(4-methoxyphenylimino)ethyl)phenyl trifluoromethanesulfonate

: 75-16-1
methylmagnesium bromide

: 252561-46-9
4-acetyl-3-methylphenyl trifluoromethanesulfonate

Guidance literature:: methylmagnesium bromide; With dichloro(N,N,N’,N‘-tetramethylethylenediamine)zinc; In tetrahydrofuran; at 0 ℃; Inert atmosphere;

4-(1-(4-methoxyphenylimino)ethyl)phenyl trifluoromethanesulfonate; With iron(III)-acetylacetonate; 1,2-dichloro-2-methylpropane; 4,4'-di-tert-butyl-2,2'-bipyridine; In tetrahydrofuran; at 0 ℃; for 72h; Inert atmosphere;

With hydrogenchloride; water; In tetrahydrofuran; at 20 ℃; for 3h; chemoselective reaction;
DOI:10.1002/anie.200900454

Reference yield: 91.0%

: 557-21-1
dicyanozinc

: 252561-46-9
4-acetyl-3-methylphenyl trifluoromethanesulfonate

: 3-methyl-4-acetylbenzonitrile

Guidance literature:: tetrakis(triphenylphosphine) palladium⁽⁰⁾; In N,N-dimethyl-formamide; at 200 ℃; for 0.25h; microwave irradiation;
DOI:10.1021/ol027256p