CHEBI:49106 - oxepane

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ChEBI Name oxepane
ChEBI ID CHEBI:49106
Definition A saturated organic heteromonocyclic parent that is cycloheptane in which one of the methylene groups is replaced by oxygen.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H12O
Net Charge 0
Average Mass 100.15888
Monoisotopic Mass 100.089
InChI InChI=1S/C6H12O/c1-2-4-6-7-5-3-1/h1-6H2
InChIKey UHHKSVZZTYJVEG-UHFFFAOYSA-N
SMILES C1CCCOCC1
ChEBI Ontology
Outgoing oxepane (CHEBI:49106) is a cyclic ether (CHEBI:37407)
oxepane (CHEBI:49106) is a saturated organic heteromonocyclic parent (CHEBI:36389)
Incoming 2-hydroxyhexano-6-lactone (CHEBI:31046) has parent hydride oxepane (CHEBI:49106)
2-methylhexano-6-lactone (CHEBI:663) has parent hydride oxepane (CHEBI:49106)
4-isopropenyl-7-methyloxepan-2-one (CHEBI:50238) has parent hydride oxepane (CHEBI:49106)
6-hydroxyhexano-6-lactone (CHEBI:17075) has parent hydride oxepane (CHEBI:49106)
IUPAC Name
oxepane
Synonyms Sources
hexamethylene oxide ChEBI
Oxacycloheptane ChemIDplus
Manual Xref Database
Oxepane Wikipedia
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Registry Numbers Types Sources
102493 Reaxys Registry Number Reaxys
592-90-5 CAS Registry Number ChemIDplus
Last Modified
29 January 2015