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Application Area
Environmental
Environmental

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

Clinical diagnostic
Clinical diagnostic

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

Organic Chemistry
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.

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

Diethyl 2-n-Butylmalonate-[d9]

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General Information
Catalog: BLP-010768
CAS: 1189865-34-6
Molecular Formula: C11H11D9O4
Molecular Weight: 225.33
Chemical Structure
Diethyl 2-n-Butylmalonate-[d9]
Description Diethyl 2-n-Butylmalonate-[d9] is the labelled analogue of Diethyl 2-n-Butylmalonate, which is used as a reagent in the synthesis of 2,5-dihydropyrrole formyl hydroxyamino derivatives as peptide deformylase inhibitors against drug-resistant bacteria.
Synonyms Diethyl 2-n-Butylmalonate D9; Diethyl 2-(n-butyl-d9)malonate; Butyl-malonic Acid Diethyl Ester-d9; Butyl-propanedioic Acid Diethyl Ester-d9; Butylpropanedioic Acid Diethyl Ester-d9; NSC 4565-d9
IUPAC Name diethyl 2-(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)propanedioate
Related CAS 133-08-4 (unlabelled)
Isomeric SMILES [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(C(=O)OCC)C(=O)OCC
Canonical SMILES CCCCC(C(=O)OCC)C(=O)OCC
InChI InChI=1S/C11H20O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h9H,4-8H2,1-3H3/i1D3,4D2,7D2,8D2
InChI Key RPNFNBGRHCUORR-GQWSVURBSA-N
Melting Point 130-135°C
Purity 98%; 99% atom D
Solubility Soluble in Acetone, Chloroform, DMSO, Ethyl Acetate, Methanol
Appearance Liquid
Storage Store at RT
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