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Ethyl 2-Oxo-4-phenylbutyrate-[d5]

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Application Area

Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Ethyl 2-Oxo-4-phenylbutyrate-[d5]

Name: Ethyl 2-Oxo-4-phenylbutyrate-[d5]
Brand: BOC Sciences
Rating: 5 (1 reviews)

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General Information
Catalog: BLP-010808
CAS: 1189911-53-2
Molecular Formula: C12H9D5O3
Molecular Weight: 211.27

Chemical Structure

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-d5
IUPAC Name	ethyl 2-oxo-4-(2,3,4,5,6-pentadeuteriophenyl)butanoate
Related CAS	64920-29-2 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1[2H])[2H])CCC(=O)C(=O)OCC)[2H])[2H]
Canonical SMILES	CCOC(=O)C(=O)CCC1=CC=CC=C1
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
InChI Key	STPXIOGYOLJXMZ-DKFMXDSJSA-N
Purity	≥96%; ≥98% atom D
Solubility	Slightly soluble in Chloroform, Ethyl Acetate
Appearance	Colorless to Pale Yellow Oily Matter
Storage	Store at -20°C