AC1LBYJX
1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone
Also Known As: BAS 02987813|1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone|1-(5-(tert-butyl)-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl)-2-(2-isopropyl-5-methylphenoxy)ethanone|1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]ethanone|2-Pyrazoline, 5-(1,1-dimethylethyl)-5-hydroxy-3-trifluoromethyl-1-(2-isopropyl-5-methylphenoxyacetyl)-|5-tert-Butyl-1-[(2-isopropyl-5-methylphenoxy)acetyl]-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol #
| Molecular Formula | C20H27F3N2O3 |
|---|---|
| Molecular Weight | 400.1974 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 62.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.1974 |
| Monoisotopic Mass | 400.1974 |
| Heavy Atoms | 28 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 333750-69-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2C(CC(=N2)C(F)(F)F)(C(C)(C)C)O |
| InChIKey | OSMRZVVFKZLBIJ-UHFFFAOYSA-N |
Product Overview
AC1LBYJX (CAS 333750-69-9), with molecular formula C20H27F3N2O3 and molecular weight 400.1974 g/mol. IUPAC: 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone.
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