AC1LE4I1
(4Z)-4-(dimethylaminomethylidene)-2-phenyl-5-(trifluoromethyl)pyrazol-3-one
Also Known As: 11B-133|4-[(dimethylamino)methylene]-2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one|(4Z)-4-(dimethylaminomethylidene)-2-phenyl-5-(trifluoromethyl)pyrazol-3-one|(4Z)-4-[(dimethylamino)methylidene]-1-phenyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-one
CAS: 69586-72-7
| Molecular Formula | C13H12F3N3O |
|---|---|
| Molecular Weight | 283.09326 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.09326 |
| Monoisotopic Mass | 283.09326 |
| Heavy Atoms | 20 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 69586-72-7 |
|---|---|
| SMILES | CN(C)/C=C\1/C(=NN(C1=O)C2=CC=CC=C2)C(F)(F)F |
| InChIKey | ZKBSLPLEAZYVLF-NTMALXAHSA-N |
Product Overview
AC1LE4I1 (CAS 69586-72-7), with molecular formula C13H12F3N3O and molecular weight 283.09326 g/mol. IUPAC: (4Z)-4-(dimethylaminomethylidene)-2-phenyl-5-(trifluoromethyl)pyrazol-3-one.
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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