CHEBI:81828 - pyraflufen-ethyl

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ChEBI Name pyraflufen-ethyl
ChEBI ID CHEBI:81828
Definition An ethyl ester resulting from the formal condensation of the carboxy group of pyraflufen with ethanol. A proherbicide for pyraflufen, it is used for the control of broad-leaved weeds and grasses in a variety of crops.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H13Cl2F3N2O4
Net Charge 0
Average Mass 413.176
Monoisotopic Mass 412.02045
InChI InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3
InChIKey APTZNLHMIGJTEW-UHFFFAOYSA-N
SMILES C1(=C(C=C(C(=C1)OCC(OCC)=O)Cl)F)C2=NN(C(=C2Cl)OC(F)F)C
Roles Classification
Biological Role(s): EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor
An EC 1.3.3.* (oxidoreductase acting on donor CH-CH group with oxygen as acceptor) inhibitor that interferes with the action of protoporphyrinogen oxidase (EC 1.3.3.4).
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.
agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pyraflufen-ethyl (CHEBI:81828) has functional parent pyraflufen (CHEBI:138287)
pyraflufen-ethyl (CHEBI:81828) has role agrochemical (CHEBI:33286)
pyraflufen-ethyl (CHEBI:81828) has role EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor (CHEBI:73192)
pyraflufen-ethyl (CHEBI:81828) has role proherbicide (CHEBI:136646)
pyraflufen-ethyl (CHEBI:81828) is a aromatic ether (CHEBI:35618)
pyraflufen-ethyl (CHEBI:81828) is a biaryl (CHEBI:64459)
pyraflufen-ethyl (CHEBI:81828) is a ethyl ester (CHEBI:23990)
pyraflufen-ethyl (CHEBI:81828) is a monochlorobenzenes (CHEBI:83403)
pyraflufen-ethyl (CHEBI:81828) is a monofluorobenzenes (CHEBI:83575)
pyraflufen-ethyl (CHEBI:81828) is a pyrazoles (CHEBI:26410)
IUPAC Name
ethyl {2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methyl-1H-pyrazol-3-yl]-4-fluorophenoxy}acetate
Synonyms Sources
ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methyl-1H-pyrazol-3-yl]-4-fluorophenoxy]acetate Alan Wood's Pesticides
ethyl [2-chloro-5-(4-chloro-5-difluoromethoxy-1-methylpyrazol-3-yl)-4-fluorophenoxy]acetate Alan Wood's Pesticides
Manual Xrefs Databases
565 PPDB
C18554 KEGG COMPOUND
CN101828555 Patent
derivatives/pyraflufen-ethyl Alan Wood's Pesticides
View more database links
Registry Numbers Types Sources
11519423 Reaxys Registry Number Reaxys
129630-19-9 CAS Registry Number NIST Chemistry WebBook
129630-19-9 CAS Registry Number Alan Wood's Pesticides
129630-19-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
17159321 PubMed citation Europe PMC
IND43730727 Agricola citation Europe PMC
IND44405977 Agricola citation Europe PMC
Last Modified
22 August 2017