EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:133997 - flupyradifurone

Default Structure
ChEBI IDCHEBI:133997
ChEBI Nameflupyradifurone
Stars
DefinitionA tertiary amino compound that is ammonia in which the nitrogens have been replaced by (6-chloropyridin-3-yl)methyl, 2,2-difluoroethyl, and 5-oxo-2,5-dihydrofuran-3-yl groups, respectively. A nicotinic acetylcholine receptor (AChR) agonist, it is used as an insecticide to control sucking pests in a variety of crops.
Last Modified21 November 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC12H11ClF2N2O2
Net Charge0
Average Mass288.681
Monoisotopic Mass288.04771
SMILESO=C1C=C(N(Cc2ccc(Cl)nc2)CC(F)F)CO1
InChIInChI=1S/C12H11ClF2N2O2/c13-10-2-1-8(4-16-10)5-17(6-11(14)15)9-3-12(18)19-7-9/h1-4,11H,5-7H2
InChIKeyQOIYTRGFOFZNKF-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
Applications:
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.
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
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.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
ChEBI Ontology
Outgoing Relation(s)
flupyradifurone (CHEBI:133997) has role insecticide (CHEBI:24852)
flupyradifurone (CHEBI:133997) has role nicotinic acetylcholine receptor agonist (CHEBI:47958)
flupyradifurone (CHEBI:133997) is a butenolide (CHEBI:50523)
flupyradifurone (CHEBI:133997) is a enamine (CHEBI:47989)
flupyradifurone (CHEBI:133997) is a monochloropyridine (CHEBI:39172)
flupyradifurone (CHEBI:133997) is a organofluorine insecticide (CHEBI:38804)
flupyradifurone (CHEBI:133997) is a tertiary amino compound (CHEBI:50996)
IUPAC Name 
4-{[(6-chloropyridin-3-yl)methyl](2,2-difluoroethyl)amino}furan-2(5H)-one
Synonyms  Source
4-[[(6-chloro-3-pyridinyl)methyl](2,2-difluoroethyl)amino]-2(5H)-furanoneAlan Wood's Pesticides
4-[(6-chloro-3-pyridylmethyl)(2,2-difluoroethyl)amino]furan-2(5H)-oneAlan Wood's Pesticides
FlupyradifuronChEBI
Brand Name  Source
SivantoChEBI
Manual XrefsDatabases
2620PPDB
flupyradifuroneAlan Wood's Pesticides
US2011130288Patent
WO2011051151Patent
Registry NumbersSources
Reaxys:19518067Reaxys
CAS:951659-40-8Alan Wood's Pesticides
CAS:951659-40-8ChemIDplus
Citations