696-63-9
| Name | 4-METHOXYBENZENETHIOL |
| CAS | 696-63-9 |
| EINECS(EC#) | 211-799-2 |
| Molecular Formula | C7H8OS |
| MDL Number | MFCD00004849 |
| Molecular Weight | 140.2 |
| MOL File | 696-63-9.mol |
Chemical Properties
| Appearance | Colorless light yellow liquid. |
| Melting point | 291.7-295.8 °C (decomp) |
| Boiling point | 100-103 °C/13 mmHg (lit.) |
| density | 1.14 g/mL at 25 °C(lit.) |
| refractive index | n |
| Fp | 205 °F |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | Not miscible or difficult to mix. |
| form | Liquid |
| pka | 6.76±0.10(Predicted) |
| color | Clear colorless to light yellow |
| Specific Gravity | 1.140 |
| Sensitive | Stench |
| Detection Methods | GC |
| BRN | 1446910 |
| InChI | 1S/C7H8OS/c1-8-6-2-4-7(9)5-3-6/h2-5,9H,1H3 |
| InChIKey | NIFAOMSJMGEFTQ-UHFFFAOYSA-N |
| SMILES | COc1ccc(S)cc1 |
| LogP | 2.320 (est) |
Safety Data
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 2810 6.1/PG 3 |
| WGK Germany | 3 |
| RTECS | DC1800000 |
| F | 10-13-23 |
| Hazard Note | Harmful/Stench |
| HazardClass | IRRITANT, STENCH |
| PackingGroup | III |
| HS Code | 29309090 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |