Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate

Base Information

Chemical Name:Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate
CAS No.:112026-37-6
Molecular Formula:C14H17NO5
Molecular Weight:279.293
Hs Code.:
DSSTox Substance ID:DTXSID40559047

Synonyms:112026-37-6;Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate;SCHEMBL10906071;DTXSID40559047;EN300-28285617

Suppliers and Price of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate

Supply Marketing:

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

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Chemical Property of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate

Chemical Property:

XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:279.11067264
Heavy Atom Count:20
Complexity:350

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(C(=O)C)NC(=O)OCC1=CC=CC=C1

Technology Process of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate

There total 4 articles about Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-oxobutanoate 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:

: 23161-28-6,28130-04-3
N-Carbobenzoxy-DL-threoninaethylester

: 112026-37-6
ethyl 2-(benzyloxycarbonylamino)acetoacetate

Guidance literature:: With Celite; pyridinium chlorochromate; In dichloromethane; at 0 - 20 ℃; for 13h;
DOI:10.1021/ja9729591

Reference yield:

: 5618-95-1,19728-63-3,41151-16-0,80384-27-6,85995-53-5,119221-16-8
2-benzyloxycarbonylamino-3-hydroxy-butyric acid

: 112026-37-6
ethyl 2-(benzyloxycarbonylamino)acetoacetate

Guidance literature:: Multi-step reaction with 2 steps

1: conc. aq. HCl / 5 h / Heating

2: PCC, Celite / CH₂Cl₂ / 13 h / 0 - 20 °C

With hydrogenchloride; Celite; pyridinium chlorochromate; In dichloromethane;
DOI:10.1021/ja9729591

Reference yield:

: 5408-04-8
ethyl 2-hydroxyimino-3-oxobutanoate

: 112026-37-6
ethyl 2-(benzyloxycarbonylamino)acetoacetate

Guidance literature:: Multi-step reaction with 2 steps

1: aluminium amalgam, water / tetrahydrofuran / 24 h / Ambient temperature

2: tetrahydrofuran / 24 h / Ambient temperature

With aluminium amalgam; water; In tetrahydrofuran;