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Pyrifenox

CAT: 0804-HY-123002Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-123002Size:5 mg
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Description
Pyrifenox is a fungicide, which is used in fruits, ornamentals, and vegetables. Pyrifenox can be utilized as one of the assessment criteria for environmental and food safety[1].
CAS Number
88283-41-4
UNSPSC
12352005
Hazard Statement
H302
Target
Fungal
Type
Reference compound
Related Pathways
Anti-infection
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/pyrifenox.html
Smiles
ClC1=CC=C(C(Cl)=C1)/C(CC2=CC=CN=C2)=N\OC
Molecular Formula
C14H12Cl2N2O
Molecular Weight
295.16
Precautions
P264-P270-P330-P501
References & Citations
[1]Hernández-Borges J, et al., Highly sensitive analysis of multiple pesticides in foods combining solid-phase microextraction, capillary electrophoresis-mass spectrometry, and chemometrics. Electrophoresis. 2004 Jul;25 (13) :2065-2076.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Pyrifenox

a fungicide; structure in first source

CAS Number88283-41-4
PubChem CID55790
IUPAC Name1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-ylethanimine
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.2
XLogP2.5
Topological Polar Surface Area34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity312
SMILES
CON=C(CC1=CN=CC=C1)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H12Cl2N2O/c1-19-18-14(7-10-3-2-6-17-9-10)12-5-4-11(15)8-13(12)16/h2-6,8-9H,7H2,1H3
InChIKey
CKPCAYZTYMHQEX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyrifenox
CAS: 88283-41-4
CID: 55790
Formula: C14H12Cl2N2O
MW: 295.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.2
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass294.0326684
Monoisotopic Mass294.0326684
Topological Polar Surface Area34.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity312
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
CS-T-86094Pyrifenox
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TRC-P998858-25MG(E)-Pyrifenox

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