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7287-19-6

7287-19-6 structural image
Product Name: Prometryn
Formula: C10H19N5S
Synonyms: 2,4-Bis-(isopropylamino)-6-methylthio-1,3,5-triazine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Prometryn appears as colorless crystals. Used as an herbicide.
Color/Form Crystals
Odor Odorless.
Melting Point 119 °C
Solubility Solubilities in organic solvents at 25 °C. [Table#4783]
Density 1.157 g/cu cm at 20 °C
Vapor Pressure 0.000002 [mmHg]
LogP log Kow = 3.51
Stability/Shelf Life Very stable over several yr of shelf life, with only slight sensitivity to natural light & extreme temp which would occur normally.
Decomposition When heated to decomposition it emits very toxic fumes of /nitrous and sulfoxides/.
Corrosivity Non-corrosive under normal application conditions
Dissociation Constants pKa = 4.05
Collision Cross Section 160.6 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated]
Kovats Retention Index 1870 1878 1880 1883 1888 1888 1880.2 1887.2 1893.3 1881.5 1883 1863 1887.4 1883.8 1881.3 1884.9 1880
Other Experimental Properties Stable to hydrolysis at 20 °C in neutral, slightly acidic or slightly alkaline media. Hydrolyzed by warm acids and alkalis. Decomposed by U.V. irradiation.
Chemical Classes Pesticides -> Herbicides, Triazine

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P273:Avoid release to the environment.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

COMPUTED DESCRIPTORS

Molecular Weight 241.36 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 241.13611680 g/mol
Monoisotopic Mass 241.13611680 g/mol
Topological Polar Surface Area 88 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 182
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

Prometryn appears as colorless crystals. Used as an herbicide.