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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.

2,3-Desdihydrogen rac-Sitagliptin-[d4]

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General Information
Catalog: BLP-006369
CAS: 1620233-76-2
Molecular Formula: C16H9D4F6N5O
Molecular Weight: 409.32
Chemical Structure
2,3-Desdihydrogen rac-Sitagliptin-[d4]
Description 2,3-Desdihydrogen rac-Sitagliptin-[d4] is the labelled analogue of 2,3-Desdihydrogen rac-Sitagliptin, which is an intermediate of Sitagliptin.
Synonyms (2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine-d4; (2Z)-3-Amino-1-[5,6-dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one-d4; 2,3-Desdihydrogen rac-Sitagliptin-d4; Sitagliptin Impurity 34-d4
IUPAC Name (Z)-3-amino-1-[5,5,6,6-tetradeuterio-3-(trifluoromethyl)-8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one
Related CAS 767340-03-4 (unlabelled)
Canonical SMILES C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C=C(CC3=CC(=C(C=C3F)F)F)N
InChI InChI=1S/C16H13F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4-6H,1-3,7,23H2/b9-5-/i1D2,2D2
InChI Key RLSFDUAUKXKPCZ-GPBXNQQSSA-N
Solubility Soluble in Methanol
Appearance White Solid
Storage Store at 2-8°C
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