Diethyl acetamido[(2-bromophenyl)methyl]propanedioate

Base Information

Chemical Name:Diethyl acetamido[(2-bromophenyl)methyl]propanedioate
CAS No.:120667-45-0
Molecular Formula:C16H20BrNO5
Molecular Weight:386.243
Hs Code.:
DSSTox Substance ID:DTXSID00561661
Wikidata:Q82445506

Synonyms:120667-45-0;Diethyl acetamido[(2-bromophenyl)methyl]propanedioate;SCHEMBL9849152;DTXSID00561661

Suppliers and Price of Diethyl acetamido[(2-bromophenyl)methyl]propanedioate

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of Diethyl acetamido[(2-bromophenyl)methyl]propanedioate

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:385.05249
Heavy Atom Count:23
Complexity:422

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(CC1=CC=CC=C1Br)(C(=O)OCC)NC(=O)C

Technology Process of Diethyl acetamido[(2-bromophenyl)methyl]propanedioate

There total 2 articles about Diethyl acetamido[(2-bromophenyl)methyl]propanedioate 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:

: 1068-90-2
2-acetylaminomalonic acid diethyl ester

: 3433-80-5
1-Bromo-2-bromomethyl-benzene

: 120667-45-0
diethyl (acetylamino)<(2-bromophenyl)methyl>propanedioate

Guidance literature:: With sodium ethanolate; Yield given. Multistep reaction; 1.) RT, overnight, 2.) EtOH, RT, 48 h;
DOI:10.1021/jm00086a004

Reference yield:

: 13433-00-6
diethyl aminomalonate hydrochloride

: 120667-45-0
diethyl (acetylamino)<(2-bromophenyl)methyl>propanedioate

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 0 - 20 °C

2: caesium carbonate / acetonitrile / 130 °C / Microwave irradiation

With caesium carbonate; triethylamine; In dichloromethane; acetonitrile;
DOI:10.1021/acs.orglett.8b02791