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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.

1-Dehydroxy-1-dehyro-fexofenadine Methyl Ester-[d6]

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General Information
Catalog: BLP-001836
CAS: 1795031-46-7
Molecular Formula: C33H31D6NO3
Molecular Weight: 501.69
Chemical Structure
1-Dehydroxy-1-dehyro-fexofenadine Methyl Ester-[d6]
Description 1-Dehydroxy-1-dehyro-fexofenadine Methyl Ester-[d6], is the labelled analogue of 1-Dehydroxy-1-dehyro-fexofenadine Methyl Ester, which is an intermediate of Fexofenadine. Fexofenadine, sold under the brand name Allegra among others, is an antihistamine pharmaceutical drug used in the treatment of allergy symptoms, such as hay fever and urticaria. Therapeutically, fexofenadine is a selective peripheral H1-blocker.
Synonyms 1-Dehydroxy-1-dehyro-fexofenadine-d6 Methyl Ester
IUPAC Name methyl 3,3,3-trideuterio-2-[4-[4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]but-1-ynyl]phenyl]-2-(trideuteriomethyl)propanoate
Related CAS 154825-95-3 (unlabelled)
Canonical SMILES CC(C)(C1=CC=C(C=C1)C#CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C(=O)OC
InChI InChI=1S/C33H37NO3/c1-32(2,31(35)37-3)27-19-17-26(18-20-27)12-10-11-23-34-24-21-30(22-25-34)33(36,28-13-6-4-7-14-28)29-15-8-5-9-16-29/h4-9,13-20,30,36H,11,21-25H2,1-3H3/i1D3,2D3
InChI Key DKWKEPIGDFDPRT-WFGJKAKNSA-N
Purity > 98%
Appearance Yellow Oil
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