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4-[5-(4-methylphenyl)-3-trifluoromethyl-1H-pyrazol-1-yl]benzenesulfonyl chloride Structure

4-[5-(4-methylphenyl)-3-trifluoromethyl-1H-pyrazol-1-yl]benzenesulfonyl chloride

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

4-[5-(4-methylphenyl)-3-trifluoromethyl-1H-pyrazol-1-yl]benzenesulfonyl chloride Supplier