EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:28222 - 1,2,4-trichlorobenzene

ChEBI IDCHEBI:28222
ChEBI Name1,2,4-trichlorobenzene
Stars
DefinitionA trichlorobenzene with chloro substituents at positions 1, 2 and 4.
Secondary ChEBI IDsCHEBI:483, CHEBI:18861
Last Modified24 April 2018
DownloadsMolfile
FormulaC6H3Cl3
Net Charge0
Average Mass181.449
Monoisotopic Mass179.93003
SMILESClc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H
InChIKeyPBKONEOXTCPAFI-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
1,2,4-trichlorobenzene (CHEBI:28222) is a trichlorobenzene (CHEBI:27096)
IUPAC Name 
1,2,4-trichlorobenzene
Synonyms  Source
1,2,4-TrichlorobenzeneKEGG COMPOUND
Trichlorobenzene AKEGG COMPOUND
1,2,4-TrichlorbenzolChEBI
as-trichlorobenzeneNIST Chemistry WebBook
unsym-trichlorobenzeneChemIDplus
1,2,5-trichlorobenzeneUM-BBD
UniProt Name  Source
1,2,4-trichlorobenzeneUniProt
Manual XrefsDatabases
C06594KEGG COMPOUND
C06594KEGG COMPOUND
c0465UM-BBD
124-TCBMetaCyc
1,2,4-TrichlorobenzeneWikipedia
Registry NumbersSources
Gmelin:261300Gmelin
Reaxys:956819Reaxys
CAS:120-82-1KEGG COMPOUND
CAS:120-82-1ChemIDplus
CAS:120-82-1NIST Chemistry WebBook
Citations