2-(Phenylthio)aniline
- Product Name2-(Phenylthio)aniline
- CAS1134-94-7
- MFC12H11NS
- MW201.29
- EINECS413-030-8
- MOL File1134-94-7.mol
Chemical Properties
| Melting point | 43 °C(lit.) |
| Boiling point | 258 °C / 100mmHg |
| Density | 1.19±0.1 g/cm3(Predicted) |
| vapor pressure | 0.004Pa at 25℃ |
| Flash point | 175 °C |
| storage temp. | 2-8°C(protect from light) |
| solubility | soluble in Methanol |
| form | Crystalline |
| pka | 2.89±0.10(Predicted) |
| color | gray-brown |
| BRN | 2363643 |
| InChI | 1S/C12H11NS/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H,13H2 |
| InChIKey | DGBISJKLNVVJGD-UHFFFAOYSA-N |
| SMILES | Nc1ccccc1Sc2ccccc2 |
| LogP | 3.37 |
| CAS DataBase Reference | 1134-94-7(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,N |
| Risk Statements | 43-51/53 |
| Safety Statements | 24-37-61 |
| RIDADR | UN 3077 9/PG 3 |
| WGK Germany | 2 |
| F | 10-13-23 |
| HazardClass | 9 |
| PackingGroup | III |
| HS Code | 2930909899 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Chronic 2 Skin Sens. 1 |
