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2-(2-Aminoethylamino)ethanol-[d4]

General Information
Catalog: BLP-011751
CAS: 1246819-88-4
Molecular Formula: C4H8D4N2O
Molecular Weight: 108.18
Chemical Structure
2-(2-Aminoethylamino)ethanol-[d4]
Description 2-(2-Aminoethylamino)ethanol-[d4] is the labelled analogue of 2-(2-Aminoethylamino)ethanol, which is an intermediate in the production of Mitoxantrone.
Synonyms 2-(2-Aminoethylamino)ethanol-d4; Amino Alcohol EA-d4; 1-Aminooxyethylamine-d4; Aminoethylethanolamine-d4; NSC 461-d4; (2-Hydroxyethyl)ethylenediamine-d4
IUPAC Name 2-(2-aminoethylamino)-1,1,2,2-tetradeuterioethanol
Related CAS 111-41-1 (unlabelled)
Canonical SMILES C(CNCCO)N
InChI InChI=1S/C4H12N2O/c5-1-2-6-3-4-7/h6-7H,1-5H2/i3D2,4D2
InChI Key LHIJANUOQQMGNT-KHORGVISSA-N
Boiling Point 238-240 °C
Melting Point -28 °C
Purity 95% by HPLC; 98% atom D
Solubility Soluble in Chloroform, DMSO, Methanol
Appearance Colorless Oily Matter
Storage Store at 2-8°C

2-(2-Aminoethylamino)ethanol-[d4], a deuterium-labeled compound utilized in biochemical and pharmacological research, offers diverse applications. Here are the key applications:

Metabolic Pathway Studies: Delving into metabolic pathways, scientists employ 2-(2-Aminoethylamino)ethanol-[d4] to trace the intricate transformations of compounds within the body. By introducing a deuterium label, researchers can meticulously monitor the compound’s metabolic journey using advanced mass spectrometry techniques. This methodology provides crucial insights into the intricate ways substances are metabolized and utilized within biological systems.

Pharmacokinetics: At the forefront of drug research, 2-(2-Aminoethylamino)ethanol-[d4] plays a pivotal role in unraveling pharmacokinetic mechanisms. This involves comprehensively assessing a drug’s absorption, distribution, metabolism, and excretion (ADME) in the body. With its deuterium label acting as a distinctive tracer, researchers can easily detect and analyze how a drug behaves within the body, offering precise data crucial for optimizing drug dosing and enhancing therapeutic efficacy.

Stable Isotope Labeling: In the domain of protein and peptide synthesis, 2-(2-Aminoethylamino)ethanol-[d4] serves as a fundamental stable isotope-labeled compound. By replacing hydrogen atoms with deuterium, researchers gain a powerful tool for investigating protein dynamics, structure, and function utilizing advanced techniques like NMR spectroscopy. This application is indispensable in the fields of structural biology and drug design, providing invaluable insights into molecular interactions and drug-target binding processes.

Biosynthetic Pathway Elucidation: Within biochemical investigations, 2-(2-Aminoethylamino)ethanol-[d4] is instrumental in elucidating the complex biosynthetic pathways of amino alcohols and related compounds. By closely studying the incorporation and transformation of the deuterated compound, scientists can pinpoint key enzymatic reactions and intermediates in these pathways. This profound understanding is essential for advancing metabolic engineering strategies and refining biosynthetic processes, paving the way for innovative applications and discoveries in biochemistry.

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