Ethyl 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate

Base Information

Chemical Name:Ethyl 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate
CAS No.:299204-34-5
Molecular Formula:C₁₇H₂₁NO₄
Molecular Weight:303.358
Hs Code.:
DSSTox Substance ID:DTXSID801147150

Synonyms:DTXSID801147150;Ethyl 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate;299204-34-5

Suppliers and Price of Ethyl 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate

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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 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:303.14705815
Heavy Atom Count:22
Complexity:436

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)CC(=O)C1(CC1)C(=O)N(C)CC2=CC=CC=C2

Technology Process of Ethyl 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate

There total 5 articles about Ethyl 1-[[methyl(phenylmethyl)amino]carbonyl]-beta-oxocyclopropanepropanoate 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: 42.0%

: 1071-46-1
hydrogen ethyl malonate

: 1-(benzyl-methyl-carbamoyl)-cyclopropanecarbonyl chloride

: 299204-34-5
3-[(1-benzylmethylcarbamoyl)cyclopropyl]-3-oxopropionic acid ethyl ester

Guidance literature:: hydrogen ethyl malonate; With isopropylmagnesium chloride; In tetrahydrofuran; at 0 ℃; for 0.5h;

1-(benzyl-methyl-carbamoyl)-cyclopropanecarbonyl chloride; In tetrahydrofuran; at 0 ℃; for 1h; Further stages.;
DOI:10.1021/ja001088j

Reference yield:

: 3697-67-4
ethyl 1-chlorocarbonylcyclopropanecarboxylate

: 299204-34-5
3-[(1-benzylmethylcarbamoyl)cyclopropyl]-3-oxopropionic acid ethyl ester

Guidance literature:: Multi-step reaction with 4 steps

1.1: CH₂Cl₂ / 24 h / 20 °C

2.1: KOH / ethanol / 24 h / 20 °C

3.1: oxalyl chloride; DMF / CH₂Cl₂ / 2 h / 20 °C

4.1: i-PrMgCl / tetrahydrofuran / 0.5 h / 0 °C

4.2: 42 percent / tetrahydrofuran / 1 h / 0 °C

With potassium hydroxide; oxalyl dichloride; isopropylmagnesium chloride; N,N-dimethyl-formamide; In tetrahydrofuran; ethanol; dichloromethane; 1.1: Acylation / 2.1: Hydrolysis / 3.1: Chlorination / 4.1: Metallation / 4.2: Acylation;
DOI:10.1021/ja001088j

Reference yield:

: 3697-66-3
1,1-cyclopropanedicarboxylic acid monoethyl ester

: 299204-34-5
3-[(1-benzylmethylcarbamoyl)cyclopropyl]-3-oxopropionic acid ethyl ester

Guidance literature:: Multi-step reaction with 5 steps

1.1: oxalyl chloride; DMF / CH₂Cl₂ / 3 h / 20 °C

2.1: CH₂Cl₂ / 24 h / 20 °C

3.1: KOH / ethanol / 24 h / 20 °C

4.1: oxalyl chloride; DMF / CH₂Cl₂ / 2 h / 20 °C

5.1: i-PrMgCl / tetrahydrofuran / 0.5 h / 0 °C

5.2: 42 percent / tetrahydrofuran / 1 h / 0 °C

With potassium hydroxide; oxalyl dichloride; isopropylmagnesium chloride; N,N-dimethyl-formamide; In tetrahydrofuran; ethanol; dichloromethane; 1.1: Chlorination / 2.1: Acylation / 3.1: Hydrolysis / 4.1: Chlorination / 5.1: Metallation / 5.2: Acylation;
DOI:10.1021/ja001088j