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137497-61-1

137497-61-1 structural image
Product Name: SUPERCYPERMETHRIN
Formula: C22H19Cl2NO3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description An emulsifiable concentrate or wettable powder composed of a mixture of eight different isomers; [EXTOXNET]
Color/Form Viscous semi-solid
Odor Odorless
Melting Point 70 °C
Solubility Soluble in methanol, acetone, xylene, dichloromethane
Density 1.25 g/cu cm at 20 °C
Vapor Density 1.25
Vapor Pressure 1.7X10-9 mm Hg at 20 °C
LogP log Kow = 6.60
Stability/Shelf Life Relatively stable in neutral & weakly acidic media, with optimum stability at pH 4. Hydrolyzed in alkaline media. Relatively stable to light in field situations. Thermally stable up to 220 °C.
Decomposition When heated to decomp it emits toxic fumes of /cyanide, nitrogen oxides, chloride/.
Corrosivity Non-corrosive to metals
Collision Cross Section 200.6 Ų [M+Na]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Kovats Retention Index 2755 2815 2784 2825 2767.5 2790.9 2775.2 2747.6 2758.6 2768.4 2772.8
Other Experimental Properties Yellow-brown viscous semi-solid /Technical/
Chemical Classes Pesticides -> Pyrethrins/Pyrethroids

COMPUTED DESCRIPTORS

Molecular Weight 416.3 g/mol
XLogP3 6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 415.0741989 g/mol
Monoisotopic Mass 415.0741989 g/mol
Topological Polar Surface Area 59.3 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 643
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Cypermethrin is a carboxylic ester resulting from the formal condensation between 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid and the alcoholic hydroxy group of hydroxy(3-phenoxyphenyl)acetonitrile. It has a role as a pyrethroid ester insecticide, a pyrethroid ester acaricide, an agrochemical and a molluscicide. It is an organochlorine compound, a nitrile, an aromatic ether and a cyclopropanecarboxylate ester. It is functionally related to a 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid.