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CHEBI:78816 - 5-hydroxyhexan-2-one

ChEBI IDCHEBI:78816
ChEBI Name5-hydroxyhexan-2-one
Stars
DefinitionA ketone that is hexan-2-one in which one of the hydrogens at position 5 is replaced by a hydroxy group.
Last Modified12 June 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC6H12O2
Net Charge0
Average Mass116.160
Monoisotopic Mass116.08373
SMILESCC(=O)CCC(C)O
InChIInChI=1S/C6H12O2/c1-5(7)3-4-6(2)8/h5,7H,3-4H2,1-2H3
InChIKeyZSDLLTJVENEIDW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-hydroxyhexan-2-one (CHEBI:78816) is a ketone (CHEBI:17087)
5-hydroxyhexan-2-one (CHEBI:78816) is a secondary alcohol (CHEBI:35681)
Incoming Relation(s)
(5R)-5-hydroxyhexan-2-one (CHEBI:78817) is a 5-hydroxyhexan-2-one (CHEBI:78816)
IUPAC Name 
5-hydroxyhexan-2-one
Synonym  Source
5-hydroxy-2-hexanoneChemIDplus
Registry NumbersSources
Reaxys:1741900Reaxys
CAS:56745-61-0ChemIDplus
Citations