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CHEBI:228159 - bisulflufen

ChEBI IDCHEBI:228159
ChEBI Namebisulflufen
Stars
DefinitionA biphenyl that is 1,1'-biphenyl substituted by fluoro, fluoro, methyl, methyl, (2,2,2-trifluoroethyl)sulfanediyl, and (2,2,2-trifluoroethyl)sulfanediyl groups at positions 2, 2', 4, 4', 5, and 5', respectively. It is used as an acaricide.
Last Modified3 November 2023
SubmitterAdnan
DownloadsMolfile
FormulaC18H14F8S2
Net Charge0
Average Mass446.428
Monoisotopic Mass446.04092
SMILESCc1cc(F)c(-c2cc(SCC(F)(F)F)c(C)cc2F)cc1SCC(F)(F)F
InChIInChI=1S/C18H14F8S2/c1-9-3-13(19)11(5-15(9)27-7-17(21,22)23)12-6-16(10(2)4-14(12)20)28-8-18(24,25)26/h3-6H,7-8H2,1-2H3
InChIKeyYZDHQIZLRLUVCB-UHFFFAOYSA-N
Roles Classification
Application:
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
ChEBI Ontology
Outgoing Relation(s)
bisulflufen (CHEBI:228159) has role acaricide (CHEBI:22153)
bisulflufen (CHEBI:228159) is a aryl sulfide (CHEBI:35683)
bisulflufen (CHEBI:228159) is a biphenyls (CHEBI:22888)
bisulflufen (CHEBI:228159) is a monofluorobenzenes (CHEBI:83575)
IUPAC Name 
2,2'-difluoro-4,4'-dimethyl-5,5'-bis[(2,2,2-trifluoroethyl)sulfanyl]biphenyl
Synonyms  Source
2,2'-difluoro-4,4'-dimethyl-5,5'-bis[(2,2,2-trifluoroethyl)sulfanyl]-1,1'-biphenylAlan Wood's Pesticides
2,2'-difluoro-4,4'-dimethyl-5,5'-bis[(2,2,2-trifluoroethyl)thio]biphenylAlan Wood's Pesticides
2,2'-difluoro-4,4'-dimethyl-5,5'-bis[(2,2,2-trifluoroethyl)thio]-1,1'-biphenylAlan Wood's Pesticides
Manual XrefsDatabases
bisulflufenAlan Wood's Pesticides
Registry NumbersSources
Reaxys:30171348Reaxys
CAS:1922957-45-6Alan Wood's Pesticides