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2439-01-2

2439-01-2 structural image
Product Name: Chinomethionate
Formula: C10H6N2OS2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Chinomethionat appears as yellow crystals. Non-corrosive. Used as a selective fungicide.
Color/Form Yellow crystals from benzene
Odor ODORLESS
Melting Point 171 °C
Solubility Solubility (g/L at 20 °C) in: toluene, 25; dichloromethane, 40; hexane, 1.8; isopropanol, 0.9; cyclohexanone, 18; dimethylformamide, 10; petroleum oils, 4
Density 1.556 g/cu cm at 20 °C
Vapor Pressure 0.0000002 [mmHg]
LogP log Kow = 3.78 at 20 °C
Henry's Law Constant Henry's Law constant = 6.2X10-8 atm-cu m/mol at 25 °C /Estimated/
Stability/Shelf Life Relatively stable under normal conditions. Hydrolysed in alkaline media; DT50 (22 °C) 10 days (pH 4), 80 hr (pH 7), 225 min (pH 9).
Decomposition When heated to decomposition it emits very toxic fumes of /nitrogen and sulfur oxides/.
Corrosivity Non-corrosive
Collision Cross Section 142.67 Ų [M+H]+
Kovats Retention Index 2047 2081 2060 2068.4 2054.8 2038.2 2038.6 2053.5 2085.1
Other Experimental Properties Relatively stable under normal conditions; hydrolyzes in alkaline media
Chemical Classes Pesticides -> Other Insecticides

COMPUTED DESCRIPTORS

Molecular Weight 234.3 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 0
Exact Mass 233.99215517 g/mol
Monoisotopic Mass 233.99215517 g/mol
Topological Polar Surface Area 93.4 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 287
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

Chinomethionat appears as yellow crystals. Non-corrosive. Used as a selective fungicide.