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CHEBI:133651 - florpyrauxifen-benzyl

ChEBI IDCHEBI:133651
ChEBI Nameflorpyrauxifen-benzyl
Stars
DefinitionA benzyl ester resulting from the formal condensation of the carboxy group of florpyrauxifen with the hydroxy group of benzyl alcohol. An auxin herbicide developed by Dow AgroSciences.
Last Modified5 October 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H14Cl2F2N2O3
Net Charge0
Average Mass439.245
Monoisotopic Mass438.03495
SMILESCOc1c(Cl)ccc(-c2nc(C(=O)OCc3ccccc3)c(Cl)c(N)c2F)c1F
InChIInChI=1S/C20H14Cl2F2N2O3/c1-28-19-12(21)8-7-11(14(19)23)17-15(24)16(25)13(22)18(26-17)20(27)29-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H2,25,26)
InChIKeyWNZCDFOXYNRBRB-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
synthetic auxin  A synthetic compound exhibiting auxin activity.
Application:
herbicide  A substance used to destroy plant pests.
ChEBI Ontology
Outgoing Relation(s)
florpyrauxifen-benzyl (CHEBI:133651) has functional parent florpyrauxifen (CHEBI:133650)
florpyrauxifen-benzyl (CHEBI:133651) has role herbicide (CHEBI:24527)
florpyrauxifen-benzyl (CHEBI:133651) has role synthetic auxin (CHEBI:26841)
florpyrauxifen-benzyl (CHEBI:133651) is a aminopyridine (CHEBI:38207)
florpyrauxifen-benzyl (CHEBI:133651) is a aromatic ether (CHEBI:35618)
florpyrauxifen-benzyl (CHEBI:133651) is a benzyl ester (CHEBI:90628)
florpyrauxifen-benzyl (CHEBI:133651) is a biaryl (CHEBI:64459)
florpyrauxifen-benzyl (CHEBI:133651) is a monochlorobenzenes (CHEBI:83403)
florpyrauxifen-benzyl (CHEBI:133651) is a monofluorobenzenes (CHEBI:83575)
IUPAC Name 
benzyl 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)-5-fluoropyridine-2-carboxylate
Synonyms  Source
florpyrauxifène-benzyleChEBI
benzyl 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)-5-fluoropicolinateAlan Wood's Pesticides
phenylmethyl 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)-5-fluoro-2-pyridinecarboxylateAlan Wood's Pesticides
Brand Name  Source
RinskorChEBI
Manual XrefsDatabases
derivatives/florpyrauxifen-benzylAlan Wood's Pesticides
US2012190551Patent
3097PPDB
Registry NumbersSources
Reaxys:22696018Reaxys
CAS:1390661-72-9Alan Wood's Pesticides
Citations