AC1LD8SQ structure

AC1LD8SQ

1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethanone

Also Known As: BAS 02987858|1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethanone|1-(5-tert-Butyl-5-hydroxy-3-trifluoromethyl-4,5-dihydro-pyrazol-1-yl)-2-(3,4-dimethyl-phenoxy)-ethanone|1-(5-(tert-butyl)-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl)-2-(3,4-dimethylphenoxy)ethanone|1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-2-(3,4-dimethylphenoxy)ethanone|1-[5-TERT-BUTYL-5-HYDROXY-3-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-2-(3,4-DIMETHYLPHENOXY)ETHAN-1-ONE|1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethanone|1-[5-tert-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethanone|2-Pyrazoline, 5-hydroxy-5-(1,1-dimethylethyl)-3-trifluoromethyl-1-(3,4-dimethylphenoxyacetyl)-|5-tert-Butyl-1-[(3,4-dimethylphenoxy)acetyl]-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol #

CAS: 333750-72-4
Molecular Formula C18H23F3N2O3
Molecular Weight 372.16608 g/mol
LogP 4.6
Topological Polar Surface Area 62.1 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 372.16608
Monoisotopic Mass 372.16608
Heavy Atoms 26
Complexity 571.0

Chemical Identifiers

CAS Number 333750-72-4
SMILES CC1=C(C=C(C=C1)OCC(=O)N2C(CC(=N2)C(F)(F)F)(C(C)(C)C)O)C
InChIKey BTXWJMVVMDBPBX-UHFFFAOYSA-N

Product Overview

AC1LD8SQ (CAS 333750-72-4), with molecular formula C18H23F3N2O3 and molecular weight 372.16608 g/mol. IUPAC: 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethanone.

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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.
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