957312-81-1
| Name | 3-(1-METHYL-1H-PYRAZOL-4-YL)-ISOXAZOLE-5-CARBOXYLIC ACID |
| CAS | 957312-81-1 |
| Molecular Formula | C8H7N3O3 |
| MDL Number | MFCD04970287 |
| Molecular Weight | 193.16 |
| MOL File | 957312-81-1.mol |
Chemical Properties
| Boiling point | 494.7±40.0 °C(Predicted) |
| density | 1.54±0.1 g/cm3(Predicted) |
| form | solid |
| pka | 2.15±0.10(Predicted) |
| InChI | 1S/C8H7N3O3/c1-11-4-5(3-9-11)6-2-7(8(12)13)14-10-6/h2-4H,1H3,(H,12,13) |
| InChIKey | DDSMWOCNQXPFLN-UHFFFAOYSA-N |
| SMILES | Cn1cc(cn1)-c2cc(on2)C(O)=O |
Safety Data
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 |