4-(2,4-Dimethoxyphenyl)-4-oxobutanoic acid structure

4-(2,4-Dimethoxyphenyl)-4-oxobutanoic acid

4-(2,4-dimethoxyphenyl)-4-oxobutanoic acid

Also Known As: 4-(2,4-dimethoxyphenyl)-4-oxobutanoic acid|4-(2,4-Dimethoxy-phenyl)-4-oxo-butyric acid|3-Chloro-5-fluoroaniline|4-(2,4-dimethoxyphenyl)-4-oxobutyric acid|4443AD|3-(2',4'-dimethoxybenzoyl)propionic acid|Benzenebutanoic acid,2,4-dimethoxy-g-oxo-|Benzenebutanoic acid, 2,4-dimethoxy-gamma-oxo-|3-(2,4-Dimethoxybenzoyl)-propionic acid|4-(2,4-dimethoxyphenyl)-4-oxo-butanoic acid|BAS 13070379|boronic acid, b-(3-methyl-4-pyridinyl)-|4-(2,4-dimethoxyphenyl)-4-oxobutanoicacid|3-(20,50-dimethoxybenzoyl) propionic acid|BB 0217153|4-(2,4-Dimethoxy-phenyl)-4-oxo-butyricacid|J1.058.666F|I04-5032

CAS: 4863-91-6
Molecular Formula C12H14O5
Molecular Weight 238.08412 g/mol
LogP 1.0
Topological Polar Surface Area 72.8 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 238.08412
Monoisotopic Mass 238.08412
Heavy Atoms 17
Complexity 276.0

Chemical Identifiers

CAS Number 4863-91-6
SMILES COC1=CC(=C(C=C1)C(=O)CCC(=O)O)OC
InChIKey NRTGCJCRCNCNNC-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (1 patents) Food Additives (10 patents) Heterocyclic Building Blocks (6 patents) Pharmaceutical Intermediates (3 patents)

Product Overview

4-(2,4-Dimethoxyphenyl)-4-oxobutanoic acid (CAS 4863-91-6), with molecular formula C12H14O5 and molecular weight 238.08412 g/mol. IUPAC: 4-(2,4-dimethoxyphenyl)-4-oxobutanoic 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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