AC1NZHPJ structure

AC1NZHPJ

6-[(3E)-3-[(4-bromophenyl)-hydroxymethylidene]-2-(3-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid

Also Known As: CBMicro_038222|BAS 01029115|6-(3-(4-bromobenzoyl)-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)hexanoic acid|6-[(3E)-3-[(4-bromophenyl)(hydroxy)methylidene]-2-(3-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid|6-[(3E)-3-[(4-bromophenyl)-hydroxymethylidene]-2-(3-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid|6-[3-(4-bromobenzoyl)-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoic acid

CAS: 333776-71-9
Molecular Formula C23H21BrFNO5
Molecular Weight 489.05872 g/mol
LogP 4.6549
Topological Polar Surface Area 94.91 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 8
Exact Mass 489.05872
Monoisotopic Mass 489.05872
Heavy Atoms 31
Complexity 1034.5173

Chemical Identifiers

CAS Number 333776-71-9
SMILES C1=CC(=CC(=C1)F)C2/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C(=O)N2CCCCCC(=O)O

Product Overview

AC1NZHPJ (CAS 333776-71-9), with molecular formula C23H21BrFNO5 and molecular weight 489.05872 g/mol. IUPAC: 6-[(3E)-3-[(4-bromophenyl)-hydroxymethylidene]-2-(3-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid.

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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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