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95465-99-9

95465-99-9 structural image
Product Name: CADUSAFOS
Formula: C10H23O2PS2
Synonyms: O-Ethyl S,S-bis(1-methylpropyl) phosphorodithioate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless to yellow liquid; [Merck Index] Pale yellow liquid; [MSDSonline]
Color/Form Colorless to yellow liquid
Odor Flat musty-like (typical of organophosphates)
Boiling Point BP: 112-114 °C at 0.8 mm Hg
Flash Point 129.4 °C (Seta closed cup)
Solubility In water, 245 mg/L at 25 °C
Density Bulk density: 0.81-0.89 (water = 1); Weight per volume: 45-55 lb/cu ft (810-980 g/L)
Vapor Pressure 0.0009 [mmHg]
LogP log Kow = 3.90
Stability/Shelf Life Stable up to 50 °C. Half-life in light <115 days.
pH pH = 6.8 (5% slurry)
Collision Cross Section 157.35 Ų [M+H]+ 176.01 Ų [M+Na]+
Kovats Retention Index 1655.4
Chemical Classes Pesticides -> Organophosphate Insecticides

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H400:Hazardous to the aquatic environment, acute hazard
Precautionary Statement Codes P262:Do not get in eyes, on skin, or on clothing.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 270.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 270.08770932 g/mol
Monoisotopic Mass 270.08770932 g/mol
Topological Polar Surface Area 76.9 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 196
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

Cadusafos is an organic thiophosphate and an organothiophosphate insecticide. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a nematicide and an agrochemical.