3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid structure

3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid

3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid

Also Known As: 3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid|2-<2-Hydroxy-aethylmercaptomethyl>-benzimidazol|SR-01000225052-1|3-[4-[(3-bromophenyl)methylidene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic Acid|3-{(4Z)-4-[(3-Bromophenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid

CAS: 5998-99-2
Molecular Formula C18H13BrN2O3
Molecular Weight 384.01096 g/mol
LogP 3.9534
Topological Polar Surface Area 69.97 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 384.01096
Monoisotopic Mass 384.01096
Heavy Atoms 24
Complexity 902.64185

Chemical Identifiers

CAS Number 5998-99-2
SMILES CC\1=NN(C(=O)/C1=C\C2=CC(=CC=C2)Br)C3=CC=CC(=C3)C(=O)O

Product Overview

3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid (CAS 5998-99-2), with molecular formula C18H13BrN2O3 and molecular weight 384.01096 g/mol. IUPAC: 3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic 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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3-[(4Z)-4-[(3-bromophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.

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