51218-45-2
Product Name:
Metolachlor
Formula:
C15H22ClNO2
Synonyms:
2-Chloro-N-(2-ethyl-6-methylphenyl)-N-(-2-methoxy-1-methylethyl)acetamide
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Metolachlor is a tan to brown oily liquid with a slightly sweet odor. Slightly soluble in water and denser than water. Hence sinks in water. Soluble in most organic solvents. Used as a selective herbicide. |
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Color/Form | Colorless liquid |
Boiling Point | 212 °F at 0.001 mmHg (USCG, 1999) |
Melting Point | -62.1 °C |
Flash Point | greater than 230 °F (USCG, 1999) |
Solubility | Miscible with benzene, toluene, ethanol, acetone, xylene, hexane, dimethylformamide, dichloroethane, cyclohexanone, methanol, octanol, and dichloromethane. Insoluble in ethylene glycol, propylene glycol, and petroleum ether. |
Density | 1.12 (USCG, 1999) - Denser than water; will sink |
Vapor Pressure | 0.0000314 [mmHg] |
LogP | log Kow = 3.13 |
Henry's Law Constant | Henry's Law constant = 9.0X10-9 atm-cu m/mole at 20 °C |
Stability/Shelf Life | Stable up to about 275 °C. |
Autoignition Temperature | 510 °F (USCG, 1999) |
Decomposition | When heated to decompostion it emits toxic fumes of /hydrogen chloride and nitrogen oxides/. |
Corrosivity | Noncorrosive |
Refractive Index | Index of refraction: 1.5301 at 20 °C/D |
Collision Cross Section | 161.46 Ų [M+H]+ [CCS Type: DT, Method: stepped-field] |
Chemical Classes | Pesticides -> Herbicides, Chloracetanilide |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H317:Sensitisation, Skin |
Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
Molecular Weight | 283.79 g/mol |
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XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 6 |
Exact Mass | 283.1339066 g/mol |
Monoisotopic Mass | 283.1339066 g/mol |
Topological Polar Surface Area | 29.5 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 285 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Metolachlor is a tan to brown oily liquid with a slightly sweet odor. Slightly soluble in water and denser than water. Hence sinks in water. Soluble in most organic solvents. Used as a selective herbicide.