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101463-69-8

101463-69-8 structural image
Product Name: Flufenoxuron
Formula: C21H11ClF6N2O3
Synonyms: N-{4-[2-Chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenylaminocarbonyl}-2,6-difluoro-benzamide
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Colorless crystals
Odor Odorless
Melting Point 169-172 °C (decomposes)
Solubility In xylene 6, n-hexane 0.11, cyclohexane 95, dichloromethane 18.8, methanol 3.5, acetone 73.8 (all in g/L, 25 °C)
Density Relative density = 1.57 g/mL
Vapor Pressure 6.52X10-9 mPa /SRC: 4.89X10-14 mm Hg/ at 20 °C
LogP log Kow = 6.16
Decomposition When heated to decomposition it emits toxic vapors of /nitrogen oxides, hydrogen fluoride and hydrogen chloride/.
pH pH = 6.1
Dissociation Constants pKa = 10.1 (calc)
Collision Cross Section 204.46 Ų [M+H]+ [CCS Type: TW]
Other Experimental Properties White, crystalline solid /Technical form/

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H362:Reproductive toxicity, effects on or via lactation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P263:Avoid contact during pregnancy/while nursing.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P273:Avoid release to the environment.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 488.8 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 488.0362389 g/mol
Monoisotopic Mass 488.0362389 g/mol
Topological Polar Surface Area 67.4 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 689
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

Flufenoxuron is a benzoylurea insecticide, a member of monochlorobenzenes, a member of (trifluoromethyl)benzenes, a member of monofluorobenzenes and a difluorobenzene. It has a role as a mite growth regulator. It is functionally related to a diphenyl ether.