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CHEBI:78877 - 1,3-indandione

ChEBI IDCHEBI:78877
ChEBI Name1,3-indandione
Stars
DefinitionA member of the class of indanones that is indane in which the hydrogens at positions 2 and 4 have been replaced by oxo groups.
Last Modified24 June 2014
DownloadsMolfile
FormulaC9H6O2
Net Charge0
Average Mass146.145
Monoisotopic Mass146.03678
SMILESO=C1CC(=O)c2ccccc21
InChIInChI=1S/C9H6O2/c10-8-5-9(11)7-4-2-1-3-6(7)8/h1-4H,5H2
InChIKeyUHKAJLSKXBADFT-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
1,3-indandione (CHEBI:78877) is a aromatic ketone (CHEBI:76224)
1,3-indandione (CHEBI:78877) is a indanones (CHEBI:24789)
1,3-indandione (CHEBI:78877) is a β-diketone (CHEBI:67265)
IUPAC Name 
1H-indene-1,3(2H)-dione
Synonyms  Source
1,3-indanoneChemIDplus
1,3-diketohydrindeneChemIDplus
indan-1,3-dioneChemIDplus
1,3-indanedioneNIST Chemistry WebBook
diketohydrindeneNIST Chemistry WebBook
Manual XrefsDatabases
1,3-IndandioneWikipedia
Registry NumbersSources
Reaxys:1210061Reaxys
CAS:606-23-5ChemIDplus
CAS:606-23-5NIST Chemistry WebBook