Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester

Base Information

Chemical Name:Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester
CAS No.:823214-61-5
Molecular Formula:C14H17ClO4
Molecular Weight:284.74
Hs Code.:
DSSTox Substance ID:DTXSID80462046
Nikkaji Number:J2.167.841D

Synonyms:Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester;823214-61-5;ETHYL 2-(4-CHLOROPHENOXY)-3-OXOHEXANOATE;DTXSID80462046

Suppliers and Price of Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester

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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price

Total 1 raw suppliers

Chemical Property of Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:284.0815367
Heavy Atom Count:19
Complexity:298

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCC(=O)C(C(=O)OCC)OC1=CC=C(C=C1)Cl

Technology Process of Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester

There total 2 articles about Hexanoic acid, 2-(4-chlorophenoxy)-3-oxo-, ethyl ester 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: 70.0%

: 67271-32-3
ethyl 2-chloro-3-oxohexanoate

: 1193-00-6
sodium 4-chlorophenolate

: 823214-61-5
ethyl 2-(4-chlorophenoxy)-3-oxohexanoate

Guidance literature:: In toluene; at 80 ℃; for 24h;
DOI:10.1016/j.ejmech.2004.09.018

Reference yield:

: 3249-68-1
ethyl butyroyl acetate

: 823214-61-5
ethyl 2-(4-chlorophenoxy)-3-oxohexanoate

Guidance literature:: Multi-step reaction with 2 steps

1: 64 percent / SO₂Cl₂ / 3 h / 20 °C

2: 70 percent / toluene / 24 h / 80 °C

With sulfuryl dichloride; In toluene;
DOI:10.1016/j.ejmech.2004.09.018