3-Ethyl-1-(4-iodobenzoyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone
Also Known As: BAS 00687610|AG-690/11741347|3-Ethyl-1-(4-iodobenzoyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol|[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone|3-ethyl-5-hydroxy-5-(trifluoromethyl)(2-pyrazolinyl) 4-iodophenyl ketone|(3-Ethyl-5-hydroxy-5-trifluoromethyl-4,5-dihydro-pyrazol-1-yl)-(4-iodo-phenyl)-methanone|3-Ethyl-1-(4-iodobenzoyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol #
| Molecular Formula | C13H12F3IN2O2 |
|---|---|
| Molecular Weight | 411.98956 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 411.98956 |
| Monoisotopic Mass | 411.98956 |
| Heavy Atoms | 21 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 330451-69-9 |
|---|---|
| SMILES | CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)I |
| InChIKey | ZXIBASCLAFKKST-UHFFFAOYSA-N |
Product Overview
3-Ethyl-1-(4-iodobenzoyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol (CAS 330451-69-9), with molecular formula C13H12F3IN2O2 and molecular weight 411.98956 g/mol. IUPAC: [3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone.
3-Ethyl-1-(4-iodobenzoyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol is a custom synthesis product. We offer services from milligram to kilogram scale.
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