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56073-10-0

56073-10-0 structural image
Product Name: Brodifacoum
Formula: C31H23BrO3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Off-white, odorless powder; [INCHEM]
Color/Form White powder
Odor Odorless
Melting Point 232 °C (Decomp) (98.7 % purity)
Solubility Forms amine salts of limited solubility in water.
Density 1.4 g/cc at 25 °C (92.5% w/w)
Vapor Pressure VP: Less than 1.33X10-7 kPa (1X10-6 mm Hg) at 25 °C
LogP log Kow: pH 5: 6.2-6.3 (10 °C), 6-6.1 (20 °C), 5.8-6.0 (30 °C); pH 7: 5.1 (10 °C), 4.9 (20 °C), 4.8 (30 °C); pH 9: 4.9 (10 °C), 4.8 (20 °C), 4.6 (30 °C)
Henry's Law Constant Henry's Law constant = 2.2X10 Pa-cu m/mole /2.2X10-8 atm-cu m/mol/ at pH 7
Stability/Shelf Life It is very stable in the environment with no loss after 30 days' exposure to direct sunlight
Decomposition When heated to decomposition it emits toxic fumes of Br-
Dissociation Constants A very weak acid which is too lipophilic to form water-soluble salts.
Chemical Classes Pesticides -> Rodenticides, Anticoagulant

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H372:Specific target organ toxicity, repeated exposure
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.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 523.4 g/mol
XLogP3 7.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 522.08306 g/mol
Monoisotopic Mass 522.08306 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 791
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

PRODUCT INTRODUCTION

description

Brodifacoum is a member of benzenes, a ring assembly and a member of naphthalenes.