CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Pale yellow odorless solid; [Merck Index] White solid; [Reference #1] |
|---|---|
| Color/Form | Pale yellow crystals |
| Odor | No noticeable odor |
| Melting Point | 150-151 °C |
| Solubility | In water, <0.01 mg/L |
| Density | Bulk density: 2.169 g/mL at 23 °C |
| Vapor Pressure | 0.0000001 [mmHg] |
| Stability/Shelf Life | Stable under recommended storage conditions. |
| Decomposition | When heated to decomposition it emits toxic vapors of /nitrogen oxides, florides and bromides/ |
| Dissociation Constants | pKa = 9.0 |
| Other Experimental Properties | log Kow = 4.26 |
| Chemical Classes | Pesticides -> Rodenticides |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06  Environment GHS09 |
| GHS Hazard Statements |
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. P284:Wear respiratory protection. P310:Immediately call a POISON CENTER or doctor/physician. P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. |
COMPUTED DESCRIPTORS
| Molecular Weight | 577.93 g/mol |
|---|---|
| XLogP3 | 6.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 576.79183 g/mol |
| Monoisotopic Mass | 574.79388 g/mol |
| Topological Polar Surface Area | 94.9 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 563 |
| 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
Bromethalin is a C-nitro compound.