CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless solid; [HSDB] |
|---|---|
| Color/Form | Colorless crystalline solid /Technical grade, 97% pure/ |
| Melting Point | 99 °C |
| Solubility | Practically insoluble in water; soluble in most organic solvents including benzene, cyclohexanone, 3,5,5-trimethylcyclohex-2-enone. |
| Density | 0.54 |
| Vapor Pressure | 0.00036 [mmHg] |
| LogP | log Kow= 2.23 |
| Stability/Shelf Life | Stable to light and at temp < 90 °C. |
| Corrosivity | Non-corrosive |
| Kovats Retention Index | 1564 1563 1564 |
| Chemical Classes | Pesticides -> Carbamate Insecticides |
COMPUTED DESCRIPTORS
| Molecular Weight | 179.22 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 179.094628657 g/mol |
| Monoisotopic Mass | 179.094628657 g/mol |
| Topological Polar Surface Area | 38.3 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 172 |
| 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
XMC is a carbamate ester. It has a role as a carbamate insecticide, an EC 3.1.1.7 (acetylcholinesterase) inhibitor and an agrochemical. It is functionally related to a methylcarbamic acid and a 3,5-xylenol.