For research use only. Not for therapeutic Use.
Ethyl 2-Oxo-4-phenylbutyrate-d5 is a deuterated compound essential for advanced pharmaceutical and biochemical research. Featuring five deuterium atoms, it provides enhanced stability and precision in mass spectrometry and NMR spectroscopy. This isotopically labeled analog is crucial for studying metabolic pathways, pharmacokinetics, and synthetic processes involving phenylbutyrate derivatives. It ensures accurate quantification and reliable analytical results, making it an ideal standard for high-precision research in drug development, organic synthesis, and the investigation of metabolic processes and enzyme interactions involving keto acids.
Catalog Number | R005908 |
CAS Number | 1189911-53-2 |
Synonyms | α-Oxo-benzenebutanoic Acid Ethyl Ester-d5; 2-Oxo-4-phenylbutyric Acid Ethyl Ester-d5; 4-Phenyl-2-oxobutyric Acid Ethyl Ester-d5; Ethyl 2-Oxo-4-phenylbutanoate-d5; Ethyl 4-Phenyl-2-oxobutanoate-d5; Ethyl 4-Phenyl-2-oxobutyrate-d5; Ethyl Benzylpyruvate |
Molecular Formula | C12H14O3 |
Purity | ≥95% |
Storage | 2°C to 8°C |
IUPAC Name | ethyl 2-oxo-4-(2,3,4,5,6-pentadeuteriophenyl)butanoate |
InChI | InChI=1S/C12H14O3/c1-2-15-12(14)11(13)9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/i3D,4D,5D,6D,7D |
InChIKey | STPXIOGYOLJXMZ-DKFMXDSJSA-N |
SMILES | CCOC(=O)C(=O)CCC1=CC=CC=C1 |