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500008-45-7

500008-45-7 structural image
Product Name: Chlorantraniliprole
Formula: C18H14BrCl2N5O2
Synonyms: 3-Bromo-N-[4-chloro-2-methyl-6-[(methylamino)carbonyl]phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide;3-Bromo-4′-chloro-1-(3-chloro-2-pyridyl)-2′-methyl-6′-(methylcarbamoyl)pyrazole-5-carboxanilide;DPX E2Y45
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Fine, crystalline, off-white powder
Melting Point 208-210 °C
Solubility Solubility in acetone 3.4, acetonitrile 0.71, dichloromethane 2.48, ethyl acetate 1.14, methanol 1.71 (all in g/L)
Density 1.1589 (95.9%); 1.507 (99.2%) at 20 °C
LogP log Kow = 2.76
Stability/Shelf Life Stable at normal temperatures and storage conditions. /DuPont Dermacor X-100 Seed Treatment/
pH pH 5.77 at 20 °C
Dissociation Constants pKa = 10.88
Other Experimental Properties MP: 200-202 °C; density: 1.5189 at 20 °C. Technical is >93% /Technical/

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P391:Collect spillage. Hazardous to the aquatic environment
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 483.1 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 480.97079 g/mol
Monoisotopic Mass 480.97079 g/mol
Topological Polar Surface Area 88.9 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 586
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Chlorantraniliprole is a carboxamide resulting from the formal condensation of the carboxylic acid group of 3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxylic acid with the primary amino group of 2-amino-5-chloro-N,3-dimethylbenzamide. The first of the anthranilic diamide insecticides, it is a ryanodine receptor activator and is used to protect a wide variety of crops, including corn, cotton, grapes, rice and potatoes. It has a role as a ryanodine receptor agonist. It is an organobromine compound, a member of pyridines, a member of pyrazoles, a pyrazole insecticide, a member of monochlorobenzenes and a secondary carboxamide.