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CHEBI:28286 - cyclohexane-1,4-dione
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ChEBI Name
cyclohexane-1,4-dione
ChEBI ID
CHEBI:28286
Definition
A cyclohexanedione with oxo substituents at positions 1 and 4.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:535, CHEBI:18929
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Formula
C6H8O2
Net Charge
0
Average Mass
112.12652
Monoisotopic Mass
112.05243
InChI
InChI=1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2
InChIKey
DCZFGQYXRKMVFG-UHFFFAOYSA-N
SMILES
O=C1CCC(=O)CC1
ChEBI Ontology
Outgoing
cyclohexane-1,4-dione (
CHEBI:28286
)
is a
cyclohexanedione (
CHEBI:23478
)
Incoming
levodione (
CHEBI:86400
)
has functional parent
cyclohexane-1,4-dione (
CHEBI:28286
)
IUPAC Name
cyclohexane-1,4-dione
Synonyms
Sources
1,4-Cyclohexanedione
KEGG COMPOUND
1,4-dioxocyclohexane
NIST Chemistry WebBook
tetrahydroquinone
NIST Chemistry WebBook
Manual Xrefs
Databases
1,4-Cyclohexanedione
Wikipedia
c0554
UM-BBD
C08063
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
101292
Gmelin Registry Number
Gmelin
637-88-7
CAS Registry Number
KEGG COMPOUND
637-88-7
CAS Registry Number
ChemIDplus
637-88-7
CAS Registry Number
NIST Chemistry WebBook
774152
Reaxys Registry Number
Reaxys
Citation
Type
Source
16504460
PubMed citation
Europe PMC
Last Modified
16 July 2015