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Esfenvalerate

CAT: 0013-GTR19173204-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19173204-01Size:50 mg
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Description
Esfenvalerate (Asana) is a synthetic pyrethroid insecticide extensively used in agricultural research. It serves as a key tool for studying insect neurotoxicity and resistance mechanisms in both in vitro electrophysiology assays and in vivo pest management models.
CAS Number
66230-04-4
Product Name Alternative
A alpha, Asana, Inhibitor, inhibit, Esfenvalerate, Halmark
Purity
99.35% (May vary between batches)
Solubility
DMSO:100 mg/mL (238.15 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (7.86 mM)
Smiles
CC (C) [C@H] (C (=O) O[C@H] (C#N) c1cccc (Oc2ccccc2) c1) c1ccc (Cl) cc1
Molecular Formula
C25H22ClNO3
Molecular Weight
419.9
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Esfenvalerate

Esfenvalerate is a fenvalerate. It has a role as an agrochemical and a pyrethroid ester insecticide.

CAS Number66230-04-4
PubChem CID10342051
IUPAC Name[(S)-cyano-(3-phenoxyphenyl)methyl] (2S)-2-(4-chlorophenyl)-3-methylbutanoate
Molecular FormulaC25H22ClNO3
Molecular Weight419.9
XLogP6.2
Topological Polar Surface Area59.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity586
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
InChI
InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1
InChIKey
NYPJDWWKZLNGGM-RPWUZVMVSA-N
Chemical Structure
2D Structure
2D structure of Esfenvalerate
CAS: 66230-04-4
CID: 10342051
Formula: C25H22ClNO3
MW: 419.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight419.9
XLogP36.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass419.1288213
Monoisotopic Mass419.1288213
Topological Polar Surface Area59.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity586
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes