1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid
- Product Name1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid
- CAS1125-29-7
- CBNumberCB5167016
- MFC7H10N2O2
- MW154.17
- MDL NumberMFCD00159648
- MOL File1125-29-7.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 215-217°C |
| Boiling point | 297.6±35.0 °C(Predicted) |
| Density | 1.24±0.1 g/cm3(Predicted) |
| storage temp. | Refrigerator, under inert atmosphere |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 3.73±0.10(Predicted) |
| color | White to Off-White |
| InChI | InChI=1S/C7H10N2O2/c1-4-6(7(10)11)5(2)9(3)8-4/h1-3H3,(H,10,11) |
| InChIKey | NOIOGQJFLIPRBI-UHFFFAOYSA-N |
| SMILES | N1(C)C(C)=C(C(O)=O)C(C)=N1 |
| CAS DataBase Reference | 1125-29-7(CAS DataBase Reference) |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H302 |
| Precautionary statements | P280-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36/37/39 |
| HazardClass | IRRITANT |
| HS Code | 29331990 |
