Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate

Base Information

Chemical Name:Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate
CAS No.:118642-73-2
Molecular Formula:C₁₅H₁₇F₃O₃
Molecular Weight:302.293
Hs Code.:
DSSTox Substance ID:DTXSID301238213

Synonyms:Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate;DTXSID301238213;118642-73-2

Suppliers and Price of Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate

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

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Chemical Property of Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:302.11297889
Heavy Atom Count:21
Complexity:347

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(CCCC1=CC=CC=C1)C(=O)C(F)(F)F

Technology Process of Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate

There total 7 articles about Ethyl alpha-(2,2,2-trifluoroacetyl)benzenepentanoate 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: 80.0%

: 118642-71-0
N,N-dimethyl hydrazono-3 trifluoro-4,4,4 (phenyl-3 propyl)-2 butanoate d'ethyle

: 118642-73-2
(phenyl-3 propyl)-2 trifluoroacetylacetate d'ethyle

Guidance literature:: With ethidium Bromide; In ethanol; for 72h; Heating;
DOI:10.1016/S0022-1139(00)82804-3

Reference yield:

: 118642-78-7
ethylenedioxy-3,3 trifluoro-4,4,4 (phenyl-3 propyl)-2 butanoate d'ethyle

: 118642-73-2
(phenyl-3 propyl)-2 trifluoroacetylacetate d'ethyle

Guidance literature:: With boron tribromide; In hexane; at -10 ℃; for 1h; Yield given;
DOI:10.1016/S0022-1139(00)82804-3

Reference yield:

: 372-31-6
ethyl 4,4,4-trifluoroacetoacetate

: 118642-73-2
(phenyl-3 propyl)-2 trifluoroacetylacetate d'ethyle

Guidance literature:: Multi-step reaction with 3 steps

1: 82 percent / ethanol / 20 h / Heating

2: 68 percent / 1M LDA; HMPT / tetrahydrofuran / 1.) 2 h; 2.) 2 h; 3.) 22 h, RT

3: 80 percent / EtBr / aq. ethanol / 72 h / Heating

With N,N,N,N,N,N-hexamethylphosphoric triamide; ethidium Bromide; lithium diisopropyl amide; In tetrahydrofuran; ethanol;
DOI:10.1016/S0022-1139(00)82804-3