CHEBI:34905 - paraquat

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name paraquat
ChEBI ID CHEBI:34905
Definition An organic cation that consists of 4,4'-bipyridine bearing two N-methyl substituents loctated at the 1- and 1'-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H14N2
Net Charge +2
Average Mass 186.25304
Monoisotopic Mass 186.11460
InChI InChI=1S/C12H14N2/c1-13-7-3-11(4-8-13)12-5-9-14(2)10-6-12/h3-10H,1-2H3/q+2
InChIKey INFDPOAKFNIJBF-UHFFFAOYSA-N
SMILES C[n+]1ccc(cc1)-c1cc[n+](C)cc1
Roles Classification
Application(s): herbicide
A substance used to destroy plant pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing paraquat (CHEBI:34905) has parent hydride 4,4'-bipyridine (CHEBI:30985)
paraquat (CHEBI:34905) has role herbicide (CHEBI:24527)
paraquat (CHEBI:34905) is a organic cation (CHEBI:25697)
Incoming paraquat dichloride (CHEBI:28786) has part paraquat (CHEBI:34905)
IUPAC Name
1,1'-dimethyl-[4,4'-bipyridin]-1,1'-diium
Synonyms Sources
1,1'-Dimethyl-4,4'-bipyridinium KEGG COMPOUND
1,1'-dimethyl-4,4'-bipyridyldiylium ChemIDplus
dimethyl viologen ChemIDplus
methyl viologen ion(2+) ChemIDplus
N,N'-dimethyl-4,4'-bipyridinium ChemIDplus
N,N'-dimethyl-4,4'-bipyridinium dication ChemIDplus
Paraquat KEGG COMPOUND
paraquat dication ChemIDplus
paraquat ion ChemIDplus
Manual Xrefs Databases
505 PPDB
C14701 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
3590305 Beilstein Registry Number Beilstein
3590305 Reaxys Registry Number Reaxys
4685-14-7 CAS Registry Number ChemIDplus
4685-14-7 CAS Registry Number NIST Chemistry WebBook
51125 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
11349957 PubMed citation Europe PMC
18620719 PubMed citation Europe PMC
20377249 PubMed citation Europe PMC
20582739 PubMed citation Europe PMC
21236547 PubMed citation Europe PMC
21300143 PubMed citation Europe PMC
21318114 PubMed citation Europe PMC
21429624 PubMed citation Europe PMC
21493003 PubMed citation Europe PMC
21598522 PubMed citation Europe PMC
21616728 PubMed citation Europe PMC
21619794 PubMed citation Europe PMC
21619822 PubMed citation Europe PMC
21750730 PubMed citation Europe PMC
21777615 PubMed citation Europe PMC
21787677 PubMed citation Europe PMC
21802509 PubMed citation Europe PMC
Last Modified
14 November 2011