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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.

rac-trans-N-Desmethyl sertraline-[d3] hydrochloride

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General Information
Catalog: BLP-000412
Molecular Formula: C16H13D3Cl3N
Molecular Weight: 331.68
Chemical Structure
rac-trans-N-Desmethyl sertraline-[d3] hydrochloride
Description rac-trans-N-Desmethyl sertraline-[d3] hydrochloride is the labelled analogue of rac-trans-N-Desmethyl sertraline hydrochloride, which is a metabolite of Sertraline.
Synonyms rac-trans-N-Desmethyl sertraline-d3 hydrochloride; trans-4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-1-naphthalenamine-d3 Hydrochloride; (±)-trans-N-Desmethylsertraline-1,2,2-d3 Hydrochloride; (±)-trans-Norsertraline HCl
IUPAC Name (1R,4S)-1,2,2-trideuterio-4-(3,4-dichlorophenyl)-3,4-dihydronaphthalen-1-amine;hydrochloride
Related CAS 1310676-34-6 (unlabelled rel-isomer) 675126-08-6 (unlabelled) 675126-05-3 (unlabelled free base)
Canonical SMILES C1CC(C2=CC=CC=C2C1C3=CC(=C(C=C3)Cl)Cl)N.Cl
InChI InChI=1S/C16H15Cl2N.ClH/c17-14-7-5-10(9-15(14)18)11-6-8-16(19)13-4-2-1-3-12(11)13;/h1-5,7,9,11,16H,6,8,19H2;1H/t11-,16+;/m0./s1/i8D2,16D;
InChI Key YKXHIERZIRLOLD-SVCVVZQUSA-N
Melting Point 256-277°C
Purity 95% by HPLC; 98% atom D
Solubility Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance Off-white to Pale Beige Solid
Storage Store at -20°C under inert atmosphere
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