78587-05-0
Product Name:
Hexythiazox
Formula:
C17H21ClN2O2S
Synonyms:
trans-5-(4-Chlorophenyl)-N-cyclohexyl-4-methyl-2-oxothiazolidine-3-carboxamide)
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | White odorless solid; [Merck Index] |
|---|---|
| Color/Form | White crystals |
| Odor | Odorless |
| Melting Point | 105.5 °C |
| Flash Point | 100.00 °C (212.00 °F) - closed cup |
| Solubility | In water, 0.5 mg/L at 20 °C |
| Vapor Pressure | 0.00000003 [mmHg] |
| Stability/Shelf Life | Stable under recommended storage conditions. |
| Decomposition | When heated to decomposition it emits toxic vapors of /nitrogen oxides, sulfur oxides, and chloride// |
| Ionization Efficiency | Positive |
| Chemical Classes | Pesticides -> Other Insecticides |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H332:Acute toxicity,inhalation H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P271:Use only outdoors or in a well-ventilated area. P273:Avoid release to the environment. P391:Collect spillage. Hazardous to the aquatic environment P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 352.9 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 352.1012268 g/mol |
| Monoisotopic Mass | 352.1012268 g/mol |
| Topological Polar Surface Area | 74.7 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 448 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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
(S,S)-hexythiazox is a hexythiazox.