2439-01-2
| Name | Chinomethionate |
| CAS | 2439-01-2 |
| EINECS(EC#) | 219-455-3 |
| Molecular Formula | C10H6N2OS2 |
| MDL Number | MFCD00055387 |
| Molecular Weight | 234.3 |
| MOL File | 2439-01-2.mol |
Chemical Properties
| Appearance | Tan to yellow crystals. Solu- ble in benzene, toluene, and dioxane; insoluble in water. |
| Melting point | 172° |
| Boiling point | 476.6±55.0 °C(Predicted) |
| density | 1.4147 (rough estimate) |
| vapor pressure | 2.6 x 10-5 Pa (20 °C) |
| refractive index | 1.6800 (estimate) |
| storage temp. | 0-6°C |
| solubility | Chloroform (Slightly), Methanol (Slightly, Heated) |
| form | Solid |
| pka | -5.28±0.20(Predicted) |
| Water Solubility | 1 mg l-1 (20 °C) |
| color | Yellow crystals |
| Merck | 13,7048 |
| InChI | 1S/C10H6N2OS2/c1-5-2-3-6-7(4-5)12-9-8(11-6)14-10(13)15-9/h2-4H,1H3 |
| InChIKey | FBQQHUGEACOBDN-UHFFFAOYSA-N |
| SMILES | Cc1ccc2nc3SC(=O)Sc3nc2c1 |
| LogP | 3.78 at 20℃ |
| NIST Chemistry Reference | Quinomethionate(2439-01-2) |
| EPA Substance Registry System | 1,3-Dithiolo[4,5- b]quinoxalin-2-one, 6-methyl-(2439-01-2) |
Safety Data
| Hazard Codes | Xn,N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN3077 9/PG 3 |
| WGK Germany | WGK 3 |
| RTECS | FG1400000 |
| HS Code | 29349990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Aquatic Acute 1 Aquatic Chronic 1 Eye Irrit. 2 Repr. 2 Skin Sens. 1A STOT RE 2 Oral |
| Hazardous Substances Data | 2439-01-2(Hazardous Substances Data) |
| Toxicity |
