5-Isopropylisoxazole-3-carboxylic acid
- Product Name5-Isopropylisoxazole-3-carboxylic acid
- CAS89776-74-9
- MFC7H9NO3
- MW155.15
- EINECS
- MOL File89776-74-9.mol
Chemical Properties
| Melting point | 69-73 °C(lit.) |
| Boiling point | 298.2±28.0 °C(Predicted) |
| Density | 1.211±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 3.43±0.10(Predicted) |
| form | solid |
| InChI | 1S/C7H9NO3/c1-4(2)6-3-5(7(9)10)8-11-6/h3-4H,1-2H3,(H,9,10) |
| InChIKey | AYWGKTMGWXRLRO-UHFFFAOYSA-N |
| SMILES | CC(C)c1cc(no1)C(O)=O |
Safety Information
| Safety Statements | 22-24/25 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2934999090 |
| Storage Class | 11 - Combustible Solids |
