AC1L4422
diethyl 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylate
Also Known As: C22-H!9-F3-N2-O4|1h-pyrazole-3,4-dicarboxylic Acid, 1-(2-(trifluoromethyl)phenyl)-5-phenyl-, Diethyl Ester|diethyl 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylate|Diethyl 5-phenyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrazole-3,4-dicarboxylate
CAS: 96722-75-7
| Molecular Formula | C22H19F3N2O4 |
|---|---|
| Molecular Weight | 432.1297 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 70.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 432.1297 |
| Monoisotopic Mass | 432.1297 |
| Heavy Atoms | 31 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 96722-75-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1C(=O)OCC)C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3 |
| InChIKey | DQGKNABXXPWUCO-UHFFFAOYSA-N |
Product Overview
AC1L4422 (CAS 96722-75-7), with molecular formula C22H19F3N2O4 and molecular weight 432.1297 g/mol. IUPAC: diethyl 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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