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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.

Metabolic Research
Metabolic Research

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

N-Desethyl Amodiaquine-[d5] Dihydrochloride

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General Information
Catalog: BLP-013058
CAS: 1216894-33-5
Molecular Formula: C18H15D5Cl3N3O
Molecular Weight: 405.76
Chemical Structure
N-Desethyl Amodiaquine-[d5] Dihydrochloride
Description N-Desethyl Amodiaquine-[d5] Dihydrochloride is the labelled analogue of N-Desethyl Amodiaquine Dihydrochloride, which is a metabolite of Amodiaquine, an antimalarial.
Synonyms N-Desethyl Amodiaquine-D5 Dihydrochloride; 4-[(7-Chloro-4-quinolinyl)amino]-2-[(ethyl-d5-amino)methyl]phenol Dihydrochloride; Monodesethylamodiaquine-d5 Dihydrochloride; Desethylamodiaquine-d5 Dihydrochloride
IUPAC Name 4-[(7-chloroquinolin-4-yl)amino]-2-[(1,1,2,2,2-pentadeuterioethylamino)methyl]phenol;dihydrochloride
Related CAS 79049-30-2 (unlabelled) 79352-78-6 (unlabelled free base)
Isomeric SMILES [2H]C([2H])([2H])C([2H])([2H])NCC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.Cl.Cl
Canonical SMILES CCNCC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.Cl.Cl
InChI InChI=1S/C18H18ClN3O.2ClH/c1-2-20-11-12-9-14(4-6-18(12)23)22-16-7-8-21-17-10-13(19)3-5-15(16)17;;/h3-10,20,23H,2,11H2,1H3,(H,21,22);2*1H/i1D3,2D2;;
InChI Key BCYBRFGUODDEGH-ZWOCKVCESA-N
Purity ≥95% by HPLC; ≥99% atom D
Solubility Soluble in Methanol (Slightly), Water (Slightly, Heated)
Appearance White to Yellow Solid
Storage Store at -20°C under inert atmosphere
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