4-[5-(4-methylphenyl)-3-trifluoromethyl-1H-pyrazol-1-yl]benzenesulfonyl chloride
- Product Name4-[5-(4-methylphenyl)-3-trifluoromethyl-1H-pyrazol-1-yl]benzenesulfonyl chloride
- CAS190711-56-9
- MFC17H12ClF3N2O2S
- MW400.8
- EINECS
- MOL File190711-56-9.mol
Chemical Properties
| Melting point | 85-87 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3)) |
| Boiling point | 489.6±45.0 °C(Predicted) |
| Density | 1.43±0.1 g/cm3(Predicted) |
| pka | -4.42±0.10(Predicted) |
| InChI | InChI=1S/C17H12ClF3N2O2S/c1-11-2-4-12(5-3-11)15-10-16(17(19,20)21)22-23(15)13-6-8-14(9-7-13)26(18,24)25/h2-10H,1H3 |
| InChIKey | PUSLMFHAVRXHIB-UHFFFAOYSA-N |
| SMILES | C1(S(Cl)(=O)=O)=CC=C(N2C(C3=CC=C(C)C=C3)=CC(C(F)(F)F)=N2)C=C1 |