Pyridalyl - ≥95% , CAS No.179101-81-6

CAS: 179101-81-6 Cat. No.: P726046 Molecular Weight: 491.1 EC Number: 605-845-4 PubChem CID: 11488729

GRADE & PURITY ≥95%

Synonyms

2-{3-{2,6-Dichloro-4-[(3,3-dichloro-2-propen-1-yl)oxy]phenoxy}propoxy}-5-(trifluoromethyl)pyridine | 2,6-Dichloro-4-(3,3-dichloroallyloxy)phenyl]-3-(5-trifluoromethyl-2-pyridyloxy)propyl ether

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Overview

Pyridalyl belongs to a new class of insecticides that has no cross-resistance with any other class of insecticides. Pyridalyl acts by contact and ingestion and is effective in controlling lepidopteran and thysanopteran pests in cotton, fruits, and vegetables such as cucurbits and lettuce. 

The analytical standard can be used for the following: To determine the toxicity of pyridalyl on each growth stage of 2 insect pest species and to evaluate its cytotoxicity on the Sf9 insect and CHO-K1 mammalian cell line using the trypan blue exclusion method To assess the lethal and sublethal effects of methoxyfenozide and pyridalyl on the larval ectoparasitoid Habrobracon hebetor Investigation of the molecular action of Pyridalyl via cytochrome P450 activity using non-selective cytochrome P450 inhibitor, 1-ABT (1-aminobenzotriazole) Evaluation of in vitro insecticidal activity of pyridalyl nanosuspension in comparison to technical material and commercial product against tomato fruit and shoot borer (Helicoverpa armigera) To elucidate the persistence behavior and risk assessment of pyridalyl in tomato, cabbage, and cultivated field soil over two consecutive seasons.

Specifications

Synonyms

2-{3-{2, 6-Dichloro-4-[(3, 3-dichloro-2-propen-1-yl)oxy]phenoxy}propoxy}-5-(trifluoromethyl)pyridine | 2, 6-Dichloro-4-(3, 3-dichloroallyloxy)phenyl]-3-(5-trifluoromethyl-2-pyridyloxy)propyl ether

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 528769061
• Canonical Smiles: C1=CC(=NC=C1C(F)(F)F)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl
• IUPAC Name: 2-[3-[2,6-dichloro-4-(3,3-dichloroprop-2-enoxy)phenoxy]propoxy]-5-(trifluoromethyl)pyridine
• InChIKey: AEHJMNVBLRLZKK-UHFFFAOYSA-N
• INCHI: 1S/C18H14Cl4F3NO3/c19-13-8-12(27-7-4-15(21)22)9-14(20)17(13)29-6-1-5-28-16-3-2-11(10-26-16)18(23,24)25/h2-4,8-10H,1,5-7H2
• Isomeric SMILES: C1=CC(=NC=C1C(F)(F)F)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl
• Alternate CAS: 179101-81-6
• PubChem CID: 11488729
• MeSH Entry Terms: 2-(3-(2,6-Dichloro-4-((3,3-dichloro-2-propen-1-yl)oxy)phenoxy)propoxy)-5-(trifluoromethyl)pyridine;pyridalyl;S 1812;S-1812;S1812
• Molecular Weight: 491.1

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Level5 Chlorobenzenes
          • Level6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyridines and derivatives Aryl chlorides Heteroaromatic compounds Ketene acetals Vinyl chlorides Azacyclic compounds Chloroalkenes Organonitrogen compounds Organopnictogen compounds Alkyl fluorides Hydrocarbon derivatives Organofluorides Organochlorides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - Pyridine - Heteroaromatic compound - Ketene acetal or derivatives - Ether - Azacycle - Chloroalkene - Haloalkene - Vinyl chloride - Vinyl halide - Organoheterocyclic compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• External Descriptors: organochlorine insecticide - dichlorobenzene - organofluorine insecticide

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Rattus norvegicus (775804 Activities)

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Plutella xylostella (1838 Activities)

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Aphis craccivora (935 Activities)

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Spodoptera litura (1708 Activities)

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Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

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Cyprinidae (2 Activities)

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Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 491.100 g/mol
• XLogP3: 7.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 490.965 Da
• Monoisotopic Mass: 488.968 Da
• Topological Polar Surface Area: 40.600 Ų
• Heavy Atom Count: 29
• Formal Charge: 0
• Complexity: 511.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1