4-Mercaptophenylacetic acid
- Product Name4-Mercaptophenylacetic acid
- CAS39161-84-7
- MFC8H8O2S
- MW168.21
- EINECS
- MOL File39161-84-7.mol
Chemical Properties
| Melting point | 105-109 °C (lit.) |
| Boiling point | 336.0±17.0 °C(Predicted) |
| Density | 1.299±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | Acetonitrile (Slightly), DMSO (Slightly) |
| pka | 4.21±0.10(Predicted) |
| form | Solid |
| color | Off-White |
| Water Solubility | Slightly soluble in water. Soluble in Dichloromethane, Ethanol and Methanol |
| Sensitive | Air Sensitive |
| InChI | InChI=1S/C8H8O2S/c9-8(10)5-6-1-3-7(11)4-2-6/h1-4,11H,5H2,(H,9,10) |
| InChIKey | ORXSLDYRYTVAPC-UHFFFAOYSA-N |
| SMILES | C1(CC(O)=O)=CC=C(S)C=C1 |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 37/38-41 |
| Safety Statements | 26-36/37/39 |
| RIDADR | UN 3335 |
| WGK Germany | 3 |
| HS Code | 2930909899 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Dam. 1 Skin Irrit. 2 STOT SE 3 |