CHEBI:4893 - Ethyl 3-oxobutanoate

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ChEBI Name Ethyl 3-oxobutanoate
ChEBI ID CHEBI:4893
Stars This entity has been manually annotated by a third party.
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Formula C6H10O3
Net Charge 0
Average Mass 130.142
Monoisotopic Mass 130.063
InChI InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3
InChIKey XYIBRDXRRQCHLP-UHFFFAOYSA-N
SMILES CCOC(=O)CC(C)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Ethyl 3-oxobutanoate (CHEBI:4893) is a oxo carboxylic acid (CHEBI:25754)
Synonyms Sources
3-ketobutyric acid ethyl ester ChEBI
3-oxobutanoic acid ethyl ester ChEBI
ethyl 3-oxidanylidenebutanoate ChEBI
ethyl 3-oxobutanoate ChEBI
Ethyl 3-oxobutanoate KEGG COMPOUND
Ethyl acetoacetate KEGG COMPOUND
Manual Xref Database
C03500 KEGG COMPOUND
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Registry Number Type Source
141-97-9 CAS Registry Number KEGG COMPOUND
Last Modified
16 July 2015