Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate

Base Information

Chemical Name:Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate
CAS No.:98354-28-0
Molecular Formula:C16H20ClNO4
Molecular Weight:325.792
Hs Code.:
DSSTox Substance ID:DTXSID00542036

Synonyms:98354-28-0;Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate;SCHEMBL11008595;DTXSID00542036;KAMSBHBRHKIQJA-UHFFFAOYSA-N;ethyl 3-(4-chlorobenzoylamino)-3-isobutyrylpropionate

Suppliers and Price of Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate

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
Packaging
price

Total 3 raw suppliers

Chemical Property of Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:325.1080858
Heavy Atom Count:22
Complexity:403

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CC(C(=O)C(C)C)NC(=O)C1=CC=C(C=C1)Cl

Technology Process of Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate

There total 5 articles about Ethyl 3-(4-chlorobenzamido)-5-methyl-4-oxohexanoate 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: 92.0%

: N-(4-chlorobenzoyl)isobutyrylmethylamine

: 105-36-2
ethyl bromoacetate

: 98354-28-0
ethyl 3-(4-chlorobenzoylamino)-4-oxo-4-(2-propyl)butyrate

Guidance literature:: In N-methyl-acetamide;

Reference yield:

: 122-01-0
4-chloro-benzoyl chloride

: 98354-28-0
ethyl 3-(4-chlorobenzoylamino)-4-oxo-4-(2-propyl)butyrate

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) sodium carbonate / 1.) water, acetone, 5 deg C, 1 h; 2.) 20 deg C, 1 h

2: 93 percent / toluene; acetic anhydride / 2 h / 50 °C

3: 3.) acetic acid / 1.) pyridine, r.t., 1 h; 2.) 50-60 deg C, 2 h; 3.) 55 deg C, 2 h

With sodium carbonate; acetic acid; In acetic anhydride; toluene;
DOI:10.1248/cpb.34.4516

Reference yield:

: 68430-42-2
N-(4-chlorobenzoyl)aspartic acid β-ethyl ester

: 98354-28-0
ethyl 3-(4-chlorobenzoylamino)-4-oxo-4-(2-propyl)butyrate

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / toluene; acetic anhydride / 2 h / 50 °C

2: 3.) acetic acid / 1.) pyridine, r.t., 1 h; 2.) 50-60 deg C, 2 h; 3.) 55 deg C, 2 h

With acetic acid; In acetic anhydride; toluene;
DOI:10.1248/cpb.34.4516