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CHEBI:49106 - oxepane

ChEBI IDCHEBI:49106
ChEBI Nameoxepane
Stars
DefinitionA saturated organic heteromonocyclic parent that is cycloheptane in which one of the methylene groups is replaced by oxygen.
Last Modified29 January 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H12O
Net Charge0
Average Mass100.161
Monoisotopic Mass100.08882
SMILESC1CCCOCC1
InChIInChI=1S/C6H12O/c1-2-4-6-7-5-3-1/h1-6H2
InChIKeyUHHKSVZZTYJVEG-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
oxepane (CHEBI:49106) is a cyclic ether (CHEBI:37407)
oxepane (CHEBI:49106) is a saturated organic heteromonocyclic parent (CHEBI:36389)
Incoming Relation(s)
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  Source
OxacycloheptaneChemIDplus
hexamethylene oxideChEBI
Manual XrefsDatabases
OxepaneWikipedia
Registry NumbersSources
Reaxys:102493Reaxys
CAS:592-90-5ChemIDplus