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CHEBI:28993 - cis-acetylacrylic acid

ChEBI IDCHEBI:28993
ChEBI Namecis-acetylacrylic acid
Stars
ASCII Namecis-acetylacrylic acid
DefinitionA 4-oxo monocarboxylic acid that is (Z)-pent-2-enoic acid in which the 4-position has been oxidised to the corresponding ketone.
Secondary ChEBI IDsCHEBI:10481, CHEBI:23305
Last Modified21 February 2011
DownloadsMolfile
FormulaC5H6O3
Net Charge0
Average Mass114.100
Monoisotopic Mass114.03169
SMILESCC(=O)/C=C\C(=O)O
InChIInChI=1S/C5H6O3/c1-4(6)2-3-5(7)8/h2-3H,1H3,(H,7,8)/b3-2-
InChIKeyXGTKSWVCNVUVHG-IHWYPQMZSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
cis-acetylacrylic acid (CHEBI:28993) has functional parent pent-2-enoic acid (CHEBI:35939)
cis-acetylacrylic acid (CHEBI:28993) is a 4-oxo monocarboxylic acid (CHEBI:35950)
IUPAC Name 
(2Z)-4-oxopent-2-enoic acid
Synonyms  Source
cis-4-oxopent-2-enoic acidChEBI
(Z)-acetylacrylic acidChEBI
Manual XrefsDatabases
C07091KEGG COMPOUND
c0386UM-BBD
Registry NumbersSources
Reaxys:1720880Reaxys