CHEBI:34833 - 1,3,5-trimethylbenzene

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ChEBI Name 1,3,5-trimethylbenzene
ChEBI ID CHEBI:34833
Definition A trimethylbenzene carrying methyl substituents at positions 1, 3 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB8481427, eMolecules:500404, ZINC000008220708
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Formula C9H12
Net Charge 0
Average Mass 120.19158
Monoisotopic Mass 120.09390
InChI InChI=1S/C9H12/c1-7-4-8(2)6-9(3)5-7/h4-6H,1-3H3
InChIKey AUHZEENZYGFFBQ-UHFFFAOYSA-N
SMILES Cc1cc(C)cc(C)c1
ChEBI Ontology
Outgoing 1,3,5-trimethylbenzene (CHEBI:34833) is a trimethylbenzene (CHEBI:38641)
Incoming spiromesifen (CHEBI:38640) has functional parent 1,3,5-trimethylbenzene (CHEBI:34833)
IUPAC Name
1,3,5-trimethylbenzene
Synonyms Sources
1,3,5-Trimethylbenzene KEGG COMPOUND
3,5-dimethyltoluene ChemIDplus
Mesitylene KEGG COMPOUND
s-trimethylbenzene NIST Chemistry WebBook
sym-trimethylbenzene NIST Chemistry WebBook
Manual Xrefs Databases
C14508 KEGG COMPOUND
HMDB0041924 HMDB
Mesitylene Wikipedia
View more database links
Registry Numbers Types Sources
108-67-8 CAS Registry Number NIST Chemistry WebBook
108-67-8 CAS Registry Number ChemIDplus
2956 Gmelin Registry Number Gmelin
906806 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
16549407 PubMed citation Europe PMC
Last Modified
18 February 2014