120-53-6
| Name | 6-ETHOXY-2-MERCAPTOBENZOTHIAZOLE |
| CAS | 120-53-6 |
| EINECS(EC#) | 204-405-5 |
| Molecular Formula | C9H9NOS2 |
| MDL Number | MFCD00005782 |
| Molecular Weight | 211.3 |
| MOL File | 120-53-6.mol |
Chemical Properties
| Melting point | 198-200 °C (lit.) |
| Boiling point | 358.5±44.0 °C(Predicted) |
| density | 1.37 |
| refractive index | 1.5650 (estimate) |
| storage temp. | 2-8°C, stored under nitrogen |
| pka | 9.52±0.20(Predicted) |
| Appearance | White to off-white Solid |
| Water Solubility | Insoluble in water. |
| BRN | 152313 |
| InChI | 1S/C9H9NOS2/c1-2-11-6-3-4-7-8(5-6)13-9(12)10-7/h3-5H,2H2,1H3,(H,10,12) |
| InChIKey | HOASVNMVYBSLSU-UHFFFAOYSA-N |
| SMILES | CCOc1ccc2nc(S)sc2c1 |
| CAS DataBase Reference | 120-53-6(CAS DataBase Reference) |
| EPA Substance Registry System | 2(3H)-Benzothiazolethione, 6-ethoxy- (120-53-6) |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | DL6498000 |
| TSCA | Yes |
| HS Code | 2934208090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |