4-(3,5-Dimethyl-1H-pyrazol-4-yl)-benzoic acid
- Product Name4-(3,5-Dimethyl-1H-pyrazol-4-yl)-benzoic acid
- CAS185252-69-1
- MFC12H12N2O2
- MW216.24
- EINECS
- MOL File185252-69-1.mol
Chemical Properties
| Melting point | 126 °C |
| Boiling point | 420.8±45.0 °C(Predicted) |
| Density | 1.262±0.06 g/cm3(Predicted) |
| storage temp. | RT, protect from light |
| pka | 4.11±0.10(Predicted) |
| Appearance | White to off-white Solid |
| InChI | InChI=1S/C12H12N2O2/c1-7-11(8(2)14-13-7)9-3-5-10(6-4-9)12(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16) |
| InChIKey | JYRIFOAFECWGHB-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=C(C2=C(C)NN=C2C)C=C1 |