Ethyl 3-(dimethylamino)-3-oxopropanoate

Base Information

• Chemical Name: Ethyl 3-(dimethylamino)-3-oxopropanoate
• CAS No.: 924-61-8
• Molecular Formula: C7H13NO3
• Molecular Weight: 159.183
• NSC Number: 87250
• DSSTox Substance ID: DTXSID00293117
• Nikkaji Number: J518.789C
• Wikidata: Q82031729

Synonyms:ethyl 3-(dimethylamino)-3-oxopropanoate;924-61-8;NSC87250;ethyl a-dimethylcarbamoylacetate;SCHEMBL2007604;Propanoic acid, 3-(dimethylamino)-3-oxo-, ethyl ester;DTXSID00293117;QJFQHGCIBBNYBZ-UHFFFAOYSA-N;CCG-40503;NSC-87250

Chemical Property of Ethyl 3-(dimethylamino)-3-oxopropanoate

Chemical Property:

• Vapor Pressure: 0.0518mmHg at 25°C
• Boiling Point: 234.8°Cat760mmHg
• Flash Point: 95.8°C
• Density: 1.047g/cm³
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 159.08954328
• Heavy Atom Count: 11
• Complexity: 154

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC(=O)N(C)C

Technology Process of Ethyl 3-(dimethylamino)-3-oxopropanoate

There total 5 articles about Ethyl 3-(dimethylamino)-3-oxopropanoate 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%

hydrogen ethyl malonate (1071-46-1) + dimethyl amine (124-40-3) → ethyl 3-(dimethylamino)-3-oxopropanoate (924-61-8)

Guidance literature:

With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20 ℃; Inert atmosphere;

DOI:10.1039/b821468a

Reference yield: 72.0%

ethyl bromoacetate (105-36-2) + 3-(N,N-dimethylcarbamoyl)oxazolidin-2-one → ethyl 3-(dimethylamino)-3-oxopropanoate (924-61-8)

Guidance literature:

With zinc; In tetrahydrofuran; 1) 30 deg C, 2 h, 2) reflux, 18 h;

DOI:10.1021/jo00055a046

Reference yield:

dimethyl amine (124-40-3) + ethyl chlorocarbonylacetate (36239-09-5) → ethyl 3-(dimethylamino)-3-oxopropanoate (924-61-8)

Guidance literature:

In chloroform;

upstream raw materials:

hydrogen ethyl malonate

dimethyl amine

ethyl chlorocarbonylacetate

diethyl malonate

Downstream raw materials:

N,N-dimethyl-2-(2-nitro-phenoxy)-malonamic acid ethyl ester

2-(N-Dimethylcarbamoyl)-3-oxo-2,3-dihydro-benzoxazin-1,4

N,N-Dimethyl-benzylmalonamidsaeuremethylester

N,N-Dimethyl-methyl-benzylmalonamidsaeureaethylester

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