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86479-06-3

86479-06-3 structural image
Product Name: Hexaflumuron
Formula: C16H8Cl2F6N2O3
Synonyms: N-[3,5-Dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenylcarbamoyl]-2,6-difluorobenzamide
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless or white solid; [ICSC]
Color/Form White solid
Melting Point 202-205 °C
Solubility Methanol 11.3, xylene 5.2 (both g/l @ 20 °C)
Density Relative density (water=1): 1.7
Vapor Pressure 0.00000044 [mmHg]
LogP log Kow = 5.68
Stability/Shelf Life Undergoes 60% hydrolysis in 35 days (pH 9). Photolysis DT50 6.3 days (pH 5.0, 25 °C).
Decomposition Photolysis DT50 6.3 days (pH 5.0, 25 °C).
Collision Cross Section 188.22 Ų [M+H]+ [CCS Type: TW]
Chemical Classes Pesticides -> Other Insecticides

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 461.1 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 5
Exact Mass 459.9816165 g/mol
Monoisotopic Mass 459.9816165 g/mol
Topological Polar Surface Area 67.4 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 581
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

Hexaflumuron is an N-acylurea that is urea in which a hydrogen attached to one of the nitrogens is replaced by a 2,6-difluorobenzoyl group, while a hycrogen attached to the other nitorgen is replaced by a 3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenyl group. It is a benzoylurea insecticide, an organofluorine insecticide, an organochlorine insecticide, a dichlorobenzene, a N-acylurea and an aromatic ether.