1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-trifluoromethanesulfonate

Base Information

Chemical Name:1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-trifluoromethanesulfonate
CAS No.:117861-40-2
Molecular Formula:C₁₃H₁₅F₃O₄S
Molecular Weight:324.321
Hs Code.:
DSSTox Substance ID:DTXSID601171428

Synonyms:DTXSID601171428;1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-trifluoromethanesulfonate;117861-40-2

Suppliers and Price of 1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-trifluoromethanesulfonate

Supply Marketing:

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

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Chemical Property of 1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-trifluoromethanesulfonate

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:324.06431462
Heavy Atom Count:21
Complexity:457

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-trifluoromethanesulfonate

There total 1 articles about 1,1-Dimethyl-4-oxo-4-phenylbutyl 1,1,1-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: 83.0%

: 1493-13-6
trifluorormethanesulfonic acid

: 1078-36-0
4-methyl-1-phenyl-4-pentene-1-one

: 117861-40-2
4-methyl-1-phenyl-4-trifluoromethanesulfonyl-1-pentanone

Guidance literature:: In dichloromethane; at 25 ℃; for 1h;

Reference yield:

: 117861-40-2
4-methyl-1-phenyl-4-trifluoromethanesulfonyl-1-pentanone

: 117861-43-5
3-hydroperoxy-6,6-dimethyl-3-phenyl-1,2-dioxolane

Guidance literature:: With dihydrogen peroxide; sodium acetate; at 0 ℃; for 0.25h; Yield given;

Reference yield:

: 117861-40-2
4-methyl-1-phenyl-4-trifluoromethanesulfonyl-1-pentanone

: 117861-41-3
3-hydroxy-6,6-dimethyl-3-phenyl-1,2-dioxolane

Guidance literature:: With 1H-imidazole; dihydrogen peroxide; Yield given. Multistep reaction; 1.) CH₂Cl₂, ether, 25 deg C, 1 h; 2.) ether, 12 h, RT;