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5598-13-0

5598-13-0 structural image
Product Name: Chlorpyrifos-methyl
Formula: C7H7Cl3NO3PS
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Chlorpyrifos methyl appears as colorless crystals. Corrosive to copper, brass, iron, and tin plate. Used as an insecticide.
Color/Form White crystals
Odor Slight mercaptan
Melting Point 45.5-46.5 °C
Flash Point 182 °C (Cleveland open cup)
Solubility In water, 4.0 mg/L at 25 °C
Density 1.64 at 23 °C
Vapor Pressure 0.0000422 [mmHg]
LogP log Kow = 4.31
Stability/Shelf Life Relatively stable under neutral conditions, but hydrolysed by acids (pH 4-6) &, more readily, by alkalis (pH 8-10).
Decomposition When heated to decomposition it emits very toxic fumes of /hydrogen chloride, nitrogen oxides, phosphorus oxides, & sodium oxides/.
Collision Cross Section 161.39 Ų [M+Na]+ 153.14 Ų [M+H]+
Kovats Retention Index 1820 1820 1829 1866 1845.7 1863.6 1824 1902 1840 1860 1855.5
Chemical Classes Pesticides -> Organophosphate Insecticides

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H317:Sensitisation, Skin
H331:Acute toxicity,inhalation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352:IF ON SKIN: wash with plenty of soap and water.

COMPUTED DESCRIPTORS

Molecular Weight 322.5 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 320.894984 g/mol
Monoisotopic Mass 320.894984 g/mol
Topological Polar Surface Area 72.7 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 278
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

Chlorpyrifos methyl appears as colorless crystals. Corrosive to copper, brass, iron, and tin plate. Used as an insecticide.