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70124-77-5

70124-77-5 structural image
Product Name: FLUCYTHRINATE
Formula: C26H23F2NO4
Synonyms: α-Cyano-3-phenoxybenzyl 4-difluoromethoxy-α-isopropylphenylacetate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Thick liquid; [Merck Index] Technical product is dark amber liquid; [HSDB] Clear colorless viscous liquid; [MSDSonline]
Color/Form Viscous liquid
Boiling Point 108 °C at 0.35 mm Hg
Solubility In acetone >820, xylene 1,810, n-propanol >780, corn oil > 560, cottonseed oil >300, soya bean oil >300, hexane 90 (all in g/L, 21 °C).
Density 1.189 at 22 °C
Vapor Pressure 0.00000001 [mmHg]
LogP log Kow = 6.20
Stability/Shelf Life Stable to light.
Decomposition When heated to decomposition it emits toxic vapors of /nitrogen oxides and hydrogen fluoride/
Refractive Index Index of refraction: 1.541 at 25 °C/D
Kovats Retention Index 2795.6 2796.8 2824.8 2772.8
Other Experimental Properties Dark amber viscous liquid, with a faint ester-like odor. /Technical flucythrinate/
Chemical Classes Pesticides -> Pyrethrins/Pyrethroids

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H226:Flammable liquids
H301:Acute toxicity,oral
H332:Acute toxicity,inhalation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P273:Avoid release to the environment.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 451.5 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 10
Exact Mass 451.15951454 g/mol
Monoisotopic Mass 451.15951454 g/mol
Topological Polar Surface Area 68.6 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 650
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes