CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colorless or light brown to pale yellow liquid; [HSDB] Light yellow oily liquid; [MSDSonline] |
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Color/Form | COLORLESS OILY LIQ WHEN PURE |
Boiling Point | 144 °C @ 0.02 mm Hg |
Melting Point | < 25 °C |
Solubility | AT ROOM TEMP LESS THAN 1 G/L WATER; LESS THAN 50 G/KG IN ALIPHATIC HYDROCARBONS; MISCIBLE WITH ALCOHOLS, AROMATIC AND CHLORINATED HYDROCARBONS, KETONES, ESTERS AT ROOM TEMPERATURE |
Density | 1.222 @ 20 °C/20 °C |
Vapor Density | Relative vapor density (air = 1): 11.4 |
Vapor Pressure | Negligible at room temp |
LogP | 2.29 (estimated) |
Stability/Shelf Life | HYDROLYZED BELOW PH 3 |
Ionization Efficiency | Positive |
Refractive Index | INDEX OF REFRACTION: 1.5138 @ 20 °C/D |
Kovats Retention Index | 2010 2044 2052 2038.2 2020 2030 2038.1 |
Other Experimental Properties | Technical grade is greater than or equal to 85% pure; the technical product slowly attacks metals /technical product/ |
Chemical Classes | Pesticides -> Organophosphate Insecticides |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 Environment GHS09 |
GHS Hazard Statements |
H311:Acute toxicity,dermal H410:Hazardous to the aquatic environment, long-term hazard |
Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
Molecular Weight | 329.4 g/mol |
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XLogP3 | 2.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 9 |
Exact Mass | 329.05205208 g/mol |
Monoisotopic Mass | 329.05205208 g/mol |
Topological Polar Surface Area | 123 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 343 |
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
Mecarbam is an organic thiophosphate that is O,O-diethyl hydrogen phosphorodithioate in which the hydrogen attached to a sulfur is replaced by a 2-[(ethoxycarbonyl)(methyl)amino]-2-oxoethyl group. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an acaricide and an agrochemical. It is an organic thiophosphate, an organothiophosphate insecticide and a carbamate ester.