5-Chlorobenzooxazole-2-thiol
- Product Name5-Chlorobenzooxazole-2-thiol
- CAS22876-19-3
- MFC7H4ClNOS
- MW185.63
- EINECS
- MOL File22876-19-3.mol
Chemical Properties
| Melting point | 280-285 °C(lit.) |
| Boiling point | 278.7±42.0 °C(Predicted) |
| Density | 1.57±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 10.45±0.20(Predicted) |
| Appearance | Light yellow to brown Solid |
| InChI | 1S/C7H4ClNOS/c8-4-1-2-6-5(3-4)9-7(11)10-6/h1-3H,(H,9,11) |
| InChIKey | BOBIZYYFYLLRAH-UHFFFAOYSA-N |
| SMILES | Sc1nc2cc(Cl)ccc2o1 |
| CAS DataBase Reference | 22876-19-3(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| RTECS | DM4760000 |
| HazardClass | IRRITANT |
| HS Code | 2934999090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Toxicity | mouse,LD50,intraperitoneal,120mg/kg (120mg/kg),Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 337, 1964. |
