4-tert-Butylphenoxyacetic acid
- Product Name4-tert-Butylphenoxyacetic acid
- CAS1798-04-5
- MFC12H16O3
- MW208.25
- EINECS
- MOL File1798-04-5.mol
Chemical Properties
| Melting point | 96 °C(lit.) |
| Boiling point | 325.4±25.0 °C(Predicted) |
| Density | 1.088±0.06 g/cm3(Predicted) |
| storage temp. | Storage temp. 2-8°C |
| solubility | Sparingly Soluble (0.56 g/L) (25°C), Calc. |
| pka | 3.22±0.10(Predicted) |
| Appearance | Off-white to light yellow Solid |
| BRN | 2368208 |
| InChI | InChI=1S/C12H16O3/c1-12(2,3)9-4-6-10(7-5-9)15-8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14) |
| InChIKey | FBIGAJNVRFKBJL-UHFFFAOYSA-N |
| SMILES | C(O)(=O)COC1=CC=C(C(C)(C)C)C=C1 |
| CAS DataBase Reference | 1798-04-5(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36/37/39 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |