Ethyl 3-methyl-4-oxobutanoate

Base Information

Chemical Name:Ethyl 3-methyl-4-oxobutanoate
CAS No.:54998-57-1
Molecular Formula:C7H12O3
Molecular Weight:144.17
Hs Code.:
DSSTox Substance ID:DTXSID50514723
Nikkaji Number:J2.890.028G

Synonyms:ethyl 3-methyl-4-oxobutanoate;54998-57-1;Butanoic acid, 3-methyl-4-oxo-, ethyl ester;ethyl 3-formylbutyrate;ethyl 4-oxo-3-methylbutyrate;SCHEMBL3336259;DTXSID50514723;PTVUASUIMPCWSD-UHFFFAOYSA-N;FT-0735656

Suppliers and Price of Ethyl 3-methyl-4-oxobutanoate

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 2 raw suppliers

Chemical Property of Ethyl 3-methyl-4-oxobutanoate

Chemical Property:

XLogP3:0.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:144.078644241
Heavy Atom Count:10
Complexity:120

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Ethyl 3-methyl-4-oxobutanoate

There total 2 articles about Ethyl 3-methyl-4-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:

: 6776-19-8
ethyl (Z)-crotonate

: 201230-82-2
carbon monoxide

: 36873-42-4
ethyl 2-formylbutanoate

: 54998-57-1
ethyl 3-formylbutyrate

Guidance literature:: With hydrogen; η⁶-C6H6BPh3^-Rh(COD)⁺; 1,4-di(diphenylphosphino)-butane; In dichloromethane; at 130 ℃; for 12h; under 31028.9 Torr; Yield given. Yields of byproduct given;
DOI:10.1021/jo00039a042

Reference yield:

: 201230-82-2
carbon monoxide

: 623-70-1
ethyl (E)-crotonate

: 36873-42-4
ethyl 2-formylbutanoate

: 54998-57-1
ethyl 3-formylbutyrate

Guidance literature:: With hydrogen; η⁶-C6H6BPh3^-Rh(COD)⁺; 1,4-di(diphenylphosphino)-butane; In dichloromethane; at 130 ℃; for 12h; under 31028.9 Torr; Yield given. Yields of byproduct given;
DOI:10.1021/jo00039a042

Reference yield: 96.0%

: 54998-57-1
ethyl 3-formylbutyrate

: 3-fluoro-4-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)phenol 2,2,2 trifluoroacetate

: ethyl 4-(2-(2-fluoro-4-hydroxyphenyl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)-3-methylbutanoate

Guidance literature:: ethyl 3-formylbutyrate; 3-fluoro-4-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)phenol 2,2,2 trifluoroacetate; With triethylamine; In tetrahydrofuran; at 20 ℃; for 1h;

With sodium tris(acetoxy)borohydride; In tetrahydrofuran;