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ChEBI
> Main
CHEBI:32253 - transfluthrin
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ChEBI Ontology
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ChEBI Name
transfluthrin
ChEBI ID
CHEBI:32253
Definition
A carboxylic ester obtained by formal condensation of 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid and 2,3,5,6-tetrafluorobenzyl alcohol.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C15H12Cl2F4O2
Net Charge
0
Average Mass
371.15359
Monoisotopic Mass
370.01505
InChI
InChI=1S/C15H12Cl2F4O2/c1-
15(2)
7(3-
10(16)
17)
11(15)
14(22)
23-
5-
6-
12(20)
8(18)
4-
9(19)
13(6)
21/h3-
4,7,11H,5H2,1-
2H3/t7-
,11+/m1/s1
InChIKey
DDVNRFNDOPPVQJ-HQJQHLMTSA-N
SMILES
CC1(C)[C@H](C=C(Cl)Cl)[C@H]1C(=O)OCc1c(F)c(F)cc(F)c1F
Roles Classification
Biological Role
(s):
pyrethroid ester insecticide
Application
(s):
pyrethroid ester insecticide
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
transfluthrin (
CHEBI:32253
)
has functional parent
3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid (
CHEBI:39308
)
transfluthrin (
CHEBI:32253
)
has role
pyrethroid ester insecticide (
CHEBI:39116
)
transfluthrin (
CHEBI:32253
)
is a
carboxylic ester (
CHEBI:33308
)
transfluthrin (
CHEBI:32253
)
is a
cyclopropanes (
CHEBI:51454
)
transfluthrin (
CHEBI:32253
)
is a
organochlorine compound (
CHEBI:36683
)
transfluthrin (
CHEBI:32253
)
is a
organofluorine compound (
CHEBI:37143
)
IUPAC Name
2,3,5,6-
tetrafluorobenzyl (1
R
,3
S
)-
3-
(2,2-
dichloroethenyl)-
2,2-
dimethylcyclopropanecarboxylate
Synonyms
Sources
(2,3,5,6-Tetrafluorophenyl)methyl(1R,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate
KEGG COMPOUND
Transfluthrin
KEGG COMPOUND
Manual Xrefs
Databases
1282
PPDB
C13410
KEGG COMPOUND
D01932
KEGG DRUG
WO2010075965
Patent
WO2011030122
Patent
View more database links
Registry Numbers
Types
Sources
118712-89-3
CAS Registry Number
KEGG COMPOUND
118712-89-3
CAS Registry Number
ChemIDplus
8349003
Beilstein Registry Number
Beilstein
8349003
Reaxys Registry Number
Reaxys
Citations
Types
Sources
10414789
PubMed citation
Europe PMC
16552726
PubMed citation
Europe PMC
20410569
PubMed citation
Europe PMC
21377505
PubMed citation
Europe PMC
21736273
PubMed citation
Europe PMC
Last Modified
28 July 2014