HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one · 3H-Pyrazol-3-one, 4-[[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-methyl-
![4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one molecular structure](/img/chemical/178819847.png)
Identifiers & Physical Properties
| CAS No. | 899718-53-7 |
|---|---|
| Molecular formula | C21H16ClFN4O2 |
| Average molar mass | 410.83 g/mol |
| SMILES | CC1=NN(c2ccc(F)cc2)C(=O)C1=Cc1c(C)nn(-c2ccc(Cl)cc2)c1O |
| InChIKey | FCABZFMHXOWHAP-UHFFFAOYSA-N |
Chemical & Physical Properties
| Boiling point | 577.6±60.0 °C(Predicted) |
|---|---|
| Density | 1.40±0.1 g/cm3(Predicted) |
| pKa (acidity coefficient) | 6.99±0.50(Predicted) |