CHEBI:37513 - 5H-benzocycloheptene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5H-benzocycloheptene
ChEBI ID CHEBI:37513
ChEBI ASCII Name 5H-benzocycloheptene
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C11H10
Net Charge 0
Average Mass 142.19710
Monoisotopic Mass 142.07825
InChI InChI=1S/C11H10/c1-2-6-10-8-4-5-9-11(10)7-3-1/h1-6,8-9H,7H2
InChIKey XHVULKQHRQZNMW-UHFFFAOYSA-N
SMILES C1C=CC=Cc2ccccc12
ChEBI Ontology
Outgoing 5H-benzocycloheptene (CHEBI:37513) is a benzocycloheptene (CHEBI:37517)
Incoming purpurogallin (CHEBI:8647) has parent hydride 5H-benzocycloheptene (CHEBI:37513)
IUPAC Name
5H-benzo[7]annulene
Synonym Source
1,2-benzotropilidene ChEBI
Registry Numbers Types Sources
2038514 Beilstein Registry Number Beilstein
28193 Gmelin Registry Number Gmelin
Last Modified
05 March 2012