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1071-83-6

1071-83-6 structural image
Product Name: Glyphosate
Formula: C3H8NO5P
Synonyms: N-(Phosphonomethyl)glycine;Glyphosate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Glyphosate is an odorless white powder. Decomposition begins at approximately 419 °F (darkens). pH (1% solution in water) 2.5. (NTP, 1992)
Color/Form White crystals
Odor Odorless
Melting Point 446 °F (decomposes) (NTP, 1992)
Solubility 5 to 10 mg/mL at 64 °F (NTP, 1992)
Density 1.74 (NTP, 1992) - Denser than water; will sink
Vapor Pressure 1.94e-07 mmHg at 113 °F (NTP, 1992)
LogP log Kow = -3.40
Stability/Shelf Life Negligible volatility
Decomposition When heated to decomposition it emits very toxic fumes of /nitrogen and phosphorus oxides/.
Ionization Efficiency Positive
Dissociation Constants pKa1 = 2.34 (20 °C) /phosphate acid/; pKa2 = 5.73 (20 °C) /secondary amine/; pKa3 =10.2 (25 °C) /carboxylic acid/
Collision Cross Section 141.17 Ų [M+Na]+ [CCS Type: DT, Method: stepped-field]
Other Experimental Properties Pure glyphosate has a zwitterion structure.
Chemical Classes Pesticides -> Herbicides, Other

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H312:Acute toxicity,dermal
H318:Serious eye damage/eye irritation
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P391:Collect spillage. Hazardous to the aquatic environment
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 169.07 g/mol
XLogP3 -4.6
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 169.01400935 g/mol
Monoisotopic Mass 169.01400935 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 162
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

Glyphosate is the active ingredient in weed killer products such as RoundUp™. Glyphosate products are one of the most widely used weed killers worldwide in farms and in home gardens and lawns. These products typically contain glyphosate in combination with other ingredients that help improve the absorption of the glyphosate into the plant. Glyphosate-based formulations (GBFs) are easily bought in most stores. These products can have different combinations of other ingredients or different concentrations of glyphosate.

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