90617-39-3
| Name | 1-PHENYL-1H-5-(2'-HYDROXY-5'-METHYLPHENYL)PYRAZOLE |
| CAS | 90617-39-3 |
| Molecular Formula | C16H14N2O |
| MDL Number | MFCD02683787 |
| Molecular Weight | 250.3 |
| MOL File | 90617-39-3.mol |
Chemical Properties
| Melting point | 126-127 °C |
| Boiling point | 411.147±30.00 °C(Press: 760.00 Torr)(predicted) |
| density | 1.156±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| form | solid |
| pka | 9.820±0.43(predicted) |
| InChI | 1S/C16H14N2O/c1-12-7-8-16(19)14(11-12)15-9-10-17-18(15)13-5-3-2-4-6-13/h2-11,19H,1H3 |
| InChIKey | KJQPHCSLONHFTM-UHFFFAOYSA-N |
| SMILES | OC1=CC=C(C)C=C1C2=CC=NN2C3=CC=CC=C3 |