4-Oxo-4-(2-thienyl)butyric acid
- Product Name4-Oxo-4-(2-thienyl)butyric acid
- CAS4653-08-1
- MFC8H8O3S
- MW184.21
- EINECS225-089-5
- MOL File4653-08-1.mol
Chemical Properties
| Melting point | 118-121 °C(lit.) |
| Boiling point | 400.5±25.0 °C(Predicted) |
| Density | 1.334±0.06 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| pka | 4.44±0.17(Predicted) |
| Appearance | White to off-white Solid |
| BRN | 133870 |
| InChI | 1S/C8H8O3S/c9-6(3-4-8(10)11)7-2-1-5-12-7/h1-2,5H,3-4H2,(H,10,11) |
| InChIKey | ULJMYWHLMLRYSO-UHFFFAOYSA-N |
| SMILES | OC(=O)CCC(=O)c1cccs1 |
| CAS DataBase Reference | 4653-08-1(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| TSCA | Yes |
| HazardClass | IRRITANT |
| HS Code | 29349990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |