CHEBI:143513 - halauxifen-methyl

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name halauxifen-methyl
ChEBI ID CHEBI:143513
Definition A methyl ester resulting from the formal condensation of the carboxy group of halauxifen with methanol. It is a proherbicide used for the control of broad-leaved weeds in cereals and oilseed rape.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter jewie
Supplier Information
Download Molfile XML SDF
Formula C14H11Cl2FN2O3
Net Charge 0
Average Mass 345.150
Monoisotopic Mass 344.01308
InChI InChI=1S/C14H11Cl2FN2O3/c1-21-13-7(15)4-3-6(11(13)17)9-5-8(18)10(16)12(19-9)14(20)22-2/h3-5H,1-2H3,(H2,18,19)
InChIKey KDHKOPYYWOHESS-UHFFFAOYSA-N
SMILES N1=C(C=C(C(=C1C(=O)OC)Cl)N)C2=CC=C(C(=C2F)OC)Cl
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): synthetic auxin
A synthetic compound exhibiting auxin activity.
Application(s): proherbicide
A compound that, on administration, must undergo chemical conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the pharmacologically active herbicide for which it is a proherbicide.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing halauxifen-methyl (CHEBI:143513) has functional parent halauxifen (CHEBI:145477)
halauxifen-methyl (CHEBI:143513) has role proherbicide (CHEBI:136646)
halauxifen-methyl (CHEBI:143513) has role synthetic auxin (CHEBI:26841)
halauxifen-methyl (CHEBI:143513) is a aminopyridine (CHEBI:38207)
halauxifen-methyl (CHEBI:143513) is a biaryl (CHEBI:64459)
halauxifen-methyl (CHEBI:143513) is a chloropyridine (CHEBI:39173)
halauxifen-methyl (CHEBI:143513) is a methyl ester (CHEBI:25248)
halauxifen-methyl (CHEBI:143513) is a monochlorobenzenes (CHEBI:83403)
halauxifen-methyl (CHEBI:143513) is a monofluorobenzenes (CHEBI:83575)
halauxifen-methyl (CHEBI:143513) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name
methyl 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)pyridine-2-carboxylate
Synonyms Sources
4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)pyridine-2-carboxylic acid methyl ester ChEBI
halauxifen methyl ChEBI
halauxiphen-methyl ChEBI
methyl 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)-2-pyridinecarboxylate Alan Wood's Pesticides
methyl 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)picolinate Alan Wood's Pesticides
XDE-729 ChEBI
XR-729 ChEBI
Brand Names Sources
Arylex ChEBI
Arylex Active ChEBI
Pixxaro ChEBI
Quelex ChEBI
Manual Xrefs Databases
/derivatives/halauxifen-methyl Alan Wood's Pesticides
2631 PPDB
View more database links
Registry Numbers Types Sources
943831-98-9 CAS Registry Number Alan Wood's Pesticides
943831-98-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
25620026 PubMed citation Europe PMC
26321602 PubMed citation Europe PMC
28675627 PubMed citation Europe PMC
29407202 PubMed citation Europe PMC
IND606240563 Agricola citation Europe PMC
Last Modified
25 November 2019