1,3-BENZENEDIMETHANETHIOL
- Product Name1,3-BENZENEDIMETHANETHIOL
- CAS41563-69-3
- MFC8H10S2
- MW170.3
- EINECS
- MOL File41563-69-3.mol
Chemical Properties
| Boiling point | 168-170 °C/25 mmHg (lit.) |
| Density | 1.15 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point | >230 °F |
| storage temp. | RT, stored under nitrogen |
| form | clear liquid |
| pka | 9.36±0.10(Predicted) |
| Specific Gravity | 1.150 |
| color | Colorless to Light yellow |
| InChI | 1S/C8H10S2/c9-5-7-2-1-3-8(4-7)6-10/h1-4,9-10H,5-6H2 |
| InChIKey | JSNABGZJVWSNOB-UHFFFAOYSA-N |
| SMILES | SCc1cccc(CS)c1 |
| CAS DataBase Reference | 41563-69-3(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-37/39 |
| RIDADR | UN 3334 |
| WGK Germany | 3 |
| HS Code | 2930909899 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
