CHEBI:30395 - acetylacetonate

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ChEBI Name acetylacetonate
ChEBI ID CHEBI:30395
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C5H7O2
Net Charge -1
Average Mass 99.10788
Monoisotopic Mass 99.04515
InChI InChI=1S/C5H7O2/c1-4(6)3-5(2)7/h3H,1-2H3/q-1
InChIKey CUJRVFIICFDLGR-UHFFFAOYSA-N
SMILES [H][C-](C(C)=O)C(C)=O
ChEBI Ontology
Outgoing acetylacetonate (CHEBI:30395) is a diketone (CHEBI:46640)
acetylacetonate (CHEBI:30395) is conjugate base of acetylacetone (CHEBI:14750)
Incoming acetylacetone (CHEBI:14750) is conjugate acid of acetylacetonate (CHEBI:30395)
IUPAC Names
2,4-dioxopentan-3-ide
acetylacetonate
Synonyms Sources
2,4-pentanedione, ion(1−) ChemIDplus
acac IUPAC
acetyl acetonate ChemIDplus
Registry Numbers Types Sources
17272-66-1 CAS Registry Number ChemIDplus
2539 Gmelin Registry Number Gmelin
3536881 Beilstein Registry Number Beilstein
Last Modified
17 September 2007