4-Oxo-4-(2,4,6-trimethylanilino)but-2-enoic acid structure

4-Oxo-4-(2,4,6-trimethylanilino)but-2-enoic acid

4-oxo-4-(2,4,6-trimethylanilino)but-2-enoic acid

Also Known As: ACMC-20mc18|4-oxo-4-(2,4,6-trimethylanilino)but-2-enoic acid|Fumaranilic acid,2',4',6'-trimethyl-(6CI)|Fumaranilic acid,2',4',6'-trimethyl- (6CI)|N-(2,4,6-TRIMETHYLPHENYL)MALEAMICACID|2-Butenoic acid,4-oxo-4-[(2,4,6-trimethylphenyl)amino]-|2-Butenoic acid, 4-oxo-4-[(2,4,6-trimethylphenyl)amino]-

CAS: 189875-67-0
Molecular Formula C13H15NO3
Molecular Weight 233.1052 g/mol
LogP 2.0
Topological Polar Surface Area 66.4 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 233.1052
Monoisotopic Mass 233.1052
Heavy Atoms 17
Complexity 313.0

Chemical Identifiers

CAS Number 189875-67-0
SMILES CC1=CC(=C(C(=C1)C)NC(=O)C=CC(=O)O)C
InChIKey LIBBIQNPOBBNDV-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.

Analytical Reagents (6 patents) Biotechnology (2 patents) Heterocyclic Building Blocks (1 patents)

Product Overview

4-Oxo-4-(2,4,6-trimethylanilino)but-2-enoic acid (CAS 189875-67-0), with molecular formula C13H15NO3 and molecular weight 233.1052 g/mol. IUPAC: 4-oxo-4-(2,4,6-trimethylanilino)but-2-enoic 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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