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120928-09-8

120928-09-8 structural image
Product Name: Fenazaquin
Formula: C20H22N2O
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Colorless crystals
Melting Point 77.5-80 °C
Solubility In acetone, hexane 33-50, acetone, ethyl acetate 400-500, n-chlorobutane, chloroform, toluene, N-methyl-2-pyrrolidone >500, dichloromethane >600, dimethylformamide 300-400, ethylene glycol <5, isopropanol, methanol 50-100 (all in g/L at 23 °C)
Density 1.16
Vapor Pressure 3.4X10-3 mPa /2.55X10-8 mm Hg/ at 25 °C
LogP log Kow = 5.51 at 20 °C
Stability/Shelf Life DT50 of aqueous solution exposed to sunlight is 15 days (pH7, 25 °C)
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxides/.
Dissociation Constants pKa = 2.44
Kovats Retention Index 2499 2511 2526.8 2501.6

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H301:Acute toxicity,oral
H332:Acute toxicity,inhalation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P273:Avoid release to the environment.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 306.4 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 306.173213330 g/mol
Monoisotopic Mass 306.173213330 g/mol
Topological Polar Surface Area 35 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 357
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

Fenazaquin is a member of quinazolines. It has a role as an acaricide and a mitochondrial NADH:ubiquinone reductase inhibitor.