Terminology Service for NFDI4Health

toluene

Go to external page http://purl.obolibrary.org/obo/CHEBI_17578


The simplest member of the class toluenes consisting of a benzene core which bears a single methyl substituent.

Term info

Label

toluene

Synonyms
  • TOLUENE
  • Toluene
  • toluene
database cross reference
Subsets

3_STAR

IUPAC NAME
toluene [ IUPAC ]

charge

0

formula

C7H8

has alternative id

CHEBI:9624, CHEBI:15248, CHEBI:27022, CHEBI:44023

has obo namespace

chebi_ontology

has related synonym

Toluol, phenylmethane, Toluen, methylbenzene

id

CHEBI:17578

inchi

InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3

inchikey

YXFVVABEGXRONW-UHFFFAOYSA-N

mass

92.13842

monoisotopicmass

92.06260

smiles

Cc1ccccc1