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CHEBI:41456 - cyclopentane-1,3-dione

Default Structure
ChEBI IDCHEBI:41456
ChEBI Namecyclopentane-1,3-dione
Stars
Secondary ChEBI IDsCHEBI:36127, CHEBI:41454
Last Modified5 September 2012
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC5H6O2
Net Charge0
Average Mass98.101
Monoisotopic Mass98.03678
SMILESO=C1CCC(=O)C1
InChIInChI=1S/C5H6O2/c6-4-1-2-5(7)3-4/h1-3H2
InChIKeyLOGSONSNCYTHPS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
cyclopentane-1,3-dione (CHEBI:41456) is a cyclopentanones (CHEBI:36140)
cyclopentane-1,3-dione (CHEBI:41456) is a β-diketone (CHEBI:67265)
IUPAC Name 
cyclopentane-1,3-dione
Synonyms  Source
1,3-cyclopentadioneNIST Chemistry WebBook
1,3-cyclopentanedioneNIST Chemistry WebBook
Manual XrefsDatabases
CEJPDBeChem
Registry NumbersSources
Beilstein:1362728Beilstein
Gmelin:200797Gmelin
CAS:3859-41-4ChemIDplus
CAS:3859-41-4NIST Chemistry WebBook