ChEBI logo

ChEBI


    The database and ontology of Chemical Entities of Biological Interest

spacer

cumene (CHEBI:34656)

Search for only All in ChEBI

Main     ChEBI Ontology     Automatic Xrefs      
ChEBI Name cumene
ChEBI ID CHEBI:34656
Definition An alkylbenzene that is benzene carrying an isopropyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
See structure as:  Image  Applet
Save molfile Download Molfile
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula Source
C9H12 KEGG COMPOUND
Net Charge 0
Average Mass 120.19158
InChI
InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey
RWGFKTVRMDUZSP-UHFFFAOYSA-N
SMILES
CC(C)c1ccccc1
ChEBI Ontology
Outgoing cumene (CHEBI:34656) is a alkylbenzene (CHEBI:38976)
Incoming 2-isopropylphenol (CHEBI:38506) has parent hydride cumene (CHEBI:34656)
cumene hydroperoxide (CHEBI:78673) has parent hydride cumene (CHEBI:34656)
cuminaldehyde (CHEBI:28671) has parent hydride cumene (CHEBI:34656)
IUPAC Name
(propan-2-yl)benzene
Synonyms Sources
(1-Methylethyl)benzene ChemIDplus
2-Phenylpropane ChemIDplus
Cumene KEGG COMPOUND
Isopropylbenzene KEGG COMPOUND
Database Links Databases
C14396 KEGG COMPOUND
CPD0-2360 MetaCyc
Cumene Wikipedia
HMDB34029 HMDB
KR20140001929 Patent
View more database links
Registry Numbers Types Sources
1236613 Beilstein Registry Number Beilstein
1236613 Reaxys Registry Number Reaxys
98-82-8 CAS Registry Number KEGG COMPOUND
98-82-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
19340095 PubMed citation CiteXplore
24441387 PubMed citation CiteXplore
Last Modified
02 June 2014

spacer
spacer