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Chemical structure of Esfenvalerate

GC63637

Esfenvalerate

Also known as [(S)-cyano-(3-phenoxyphenyl)methyl] (2S)-2-(4-chlorophenyl)-3-methylbutanoate

Esfenvalerate is one of the four isomers of the pyrethroid insecticide fenvalerate

ChemicalCAS66230-04-4MW419.9FormulaC25H22ClNO3
CAS number
66230-04-4
Molecular weight
419.9
Formula
C25H22ClNO3
Solubility
DMSO ： 100 mg/mL (238·15 mM; Need ultrasonic)
InChIKey
NYPJDWWKZLNGGM-RPWUZVMVSA-N
Catalogue number
GC63637
Brand
GLPBIO
Computed properties PubChem CID 10342051 · XLogP 6.2 · TPSA 59.3 Ų · H-bond donors 0
XLogP
6.2
TPSA
59.3 Ų
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
30

SMILES CC(C)[C@@H](C1=CC=C(C=C1)Cl)C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3

Computed descriptors from PubChem (CID 10342051), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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