CHEBI:28618 - 1,4-dichlorobenzene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,4-dichlorobenzene
ChEBI ID CHEBI:28618
Definition A dichlorobenzene carrying chloro groups at positions 1 and 4.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:536, CHEBI:18930
Supplier Information
Download Molfile XML SDF
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C6H4Cl2
Net Charge 0
Average Mass 147.00136
Monoisotopic Mass 145.96901
InChI InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
InChIKey OCJBOOLMMGQPQU-UHFFFAOYSA-N
SMILES Clc1ccc(Cl)cc1
Roles Classification
Application(s): insecticide
Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,4-dichlorobenzene (CHEBI:28618) has role insecticide (CHEBI:24852)
1,4-dichlorobenzene (CHEBI:28618) is a dichlorobenzene (CHEBI:23697)
Incoming 2,5-dichloroaniline (CHEBI:34245) has functional parent 1,4-dichlorobenzene (CHEBI:28618)
IUPAC Name
1,4-dichlorobenzene
Synonyms Sources
1,4-Dichlorobenzene KEGG COMPOUND
p-chlorophenyl chloride NIST Chemistry WebBook
p-Dichlorbenzol ChemIDplus
p-Dichlorobenzene KEGG COMPOUND
PARA UM-BBD
Paradichlorbenzol NIST Chemistry WebBook
paradichlorobenzene ChemIDplus
PDCB UM-BBD
Manual Xrefs Databases
1,4-Dichlorobenzene Wikipedia
c0593 UM-BBD
C07092 KEGG COMPOUND
HMDB0041971 HMDB
WO2010122925 Patent
View more database links
Registry Numbers Types Sources
106-46-7 CAS Registry Number NIST Chemistry WebBook
106-46-7 CAS Registry Number ChemIDplus
1680023 Reaxys Registry Number Reaxys
49722 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
10817668 PubMed citation Europe PMC
17750169 PubMed citation Europe PMC
23899931 PubMed citation Europe PMC
Last Modified
23 October 2015