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(E/Z) -Acetamiprid

CAT: 0804-HY-B0823ASize: 1 EachDry Ice: NoHazardous: No
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Description
(E/Z) -Acetamiprid is the E/Z mixture of Acetamiprid. Acetamiprid is a neonicotinoid insecticide used worldwide. Acetamiprid is a nicotinic acetylcholine receptor (nAChR) agonist, and is shown to be associated with neuromuscular and reproductive disorders[1].
CAS Number
160430-64-8
UNSPSC
12352005
Hazard Statement
H301, H410
Target
Drug Isomer; nAChR
Related Pathways
Membrane Transporter/Ion Channel; Neuronal Signaling; Others
Field of Research
Neurological Disease
Purity
97.0
Smiles
C/C(N(C)CC1=CC=C(N=C1)Cl)=N\C#N
Molecular Formula
C10H11ClN4
Molecular Weight
222.67
Precautions
H301, H410
References & Citations
[1]Terayama H, et al. Effect of acetamiprid on the immature murine testes. Int J Environ Health Res. 2018 Dec;28 (6) :683-696.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-((6-Chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamide

Acetamiprid is a carboxamidine that is acetamidine in which the amino hydrogens are substituted by a (6-chloropyridin-3-yl)methyl and a methyl group while the hydrogen attached to the imino nitrogen is replaced by a cyano group. It has a role as a neonicotinoid insectide, a xenobiotic and an environmental contaminant. It is a nitrile, a carboxamidine and a monochloropyridine. It is functionally related to a 2-chloropyridine.

CAS Number160430-64-8
PubChem CID213021
IUPAC NameN-[(6-chloro-3-pyridinyl)methyl]-N'-cyano-N-methylethanimidamide
Molecular FormulaC10H11ClN4
Molecular Weight222.67
XLogP1.4
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity280
SMILES
CC(=NC#N)N(C)CC1=CN=C(C=C1)Cl
InChI
InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3
InChIKey
WCXDHFDTOYPNIE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-((6-Chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamide
CAS: 160430-64-8
CID: 213021
Formula: C10H11ClN4
MW: 222.67
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight222.67
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass222.0672241
Monoisotopic Mass222.0672241
Topological Polar Surface Area52.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity280
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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