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181274-17-9

181274-17-9 structural image
Product Name: Flucarbazone sodium
Formula: C12H12F3N4NaO6S
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Colorless, crystalline powder
Odor Odorless
Melting Point 200 °C (decomposes)
Solubility In water, 44 g/L at 20 °C (pH 9)
Vapor Pressure VP: 1X10-10 mm Hg at 20 °C
LogP log Kow: -0.89 (pH 4); -1.85 (pH 7); -1.89 (pH 9)
Decomposition When heated to decomposition it emits toxic vapors of /nitrogen oxides, sulfur oxides, and fluoride/.
Dissociation Constants pKa = 1.9

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 418.28 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 4
Exact Mass 418.01708399 g/mol
Monoisotopic Mass 418.01708399 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 711
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 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Flucarbazone-sodium is an organic sodium salt resulting from the formal reaction of the sulfonamide amino group of flucarbazone with 1 mol eq. of sodium hydride. An acetolactate synthase inhibitor, it is used as a herbicide to control grass weeds in cereal crops. Not approved for use within the European Union. It has a role as an EC 2.2.1.6 (acetolactate synthase) inhibitor, a herbicide and an agrochemical. It contains a flucarbazone(1-).