13616-82-5
| Name | 2,4-Dimethylbenzenethiol |
| CAS | 13616-82-5 |
| EINECS(EC#) | 237-100-0 |
| Molecular Formula | C8H10S |
| MDL Number | MFCD00010019 |
| Molecular Weight | 138.23 |
| MOL File | 13616-82-5.mol |
Chemical Properties
| Appearance | clear yellow liquid |
| Melting point | -30°C (estimate) |
| Boiling point | 207-208 °C (lit.) |
| density | 1.022 g/mL at 25 °C(lit.) |
| refractive index | n |
| Fp | 137 °F |
| storage temp. | Keep in dark place,Sealed in dry,2-8°C |
| solubility | soluble in Chloroform, Ethyl Acetate, Methanol |
| form | clear liquid |
| pka | 7.02±0.48(Predicted) |
| color | Colorless to Light yellow |
| Specific Gravity | 1.022 |
| Sensitive | Stench |
| Detection Methods | HPLC |
| InChI | 1S/C8H10S/c1-6-3-4-8(9)7(2)5-6/h3-5,9H,1-2H3 |
| InChIKey | AMNLXDDJGGTIPL-UHFFFAOYSA-N |
| SMILES | Cc1ccc(S)c(C)c1 |
| LogP | 3.421 (est) |
| Uses |
Safety Data
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 1993 3/PG 3 |
| WGK Germany | 3 |
| Hazard Note | Irritant/Stench |
| TSCA | T |
| HazardClass | 3 |
| PackingGroup | III |
| HS Code | 29309090 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Eye Irrit. 2 Flam. Liq. 3 Skin Irrit. 2 STOT SE 3 |