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141776-32-1

141776-32-1 structural image
Product Name: Sulfosulfuron
Formula: C16H18N6O7S2
Synonyms: 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazol[1,2-a]pyridin-3-ylsulfonyl)urea
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form White crystals
Odor Odorless
Melting Point 201.1 to 201.7 °C
Solubility In acetone 0.71, methanol 0.33, ethyl acetate 1.01, dichloromethane 4.35, xylene 0.16, heptane <0.01 (all in g/L, 20 °C)
Density 1.5185 at 20 °C
Vapor Pressure VP: 3.1X10-5 mPa (20 °C); 8.8X10-5 mPa (25 °C)
LogP log Kow = 0.73 (pH 5); -0.77 (pH 7); -1.44 (pH 9)
Stability/Shelf Life Minimum shelf life: 2 years. /Maverick Herbicide/
Dissociation Constants pKa = 3.51

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P391:Collect spillage. Hazardous to the aquatic environment
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 470.5 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 7
Exact Mass 470.06783928 g/mol
Monoisotopic Mass 470.06783928 g/mol
Topological Polar Surface Area 188 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 832
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

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