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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.

Anastrozole-[d12]

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General Information
Catalog: BLP-014000
CAS: 120512-32-5
Molecular Formula: C17H7D12N5
Molecular Weight: 305.45
Chemical Structure
Anastrozole-[d12]
Description Anastrozole-[d12] is the labelled analogue of Anastrozole, which is a medication used for breast cancer therapy.
Synonyms Anastrozole-d12; α1,α1,α3,α3-(Tetramethyl-d12)-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-benzenediacetonitrile; 2-[3-(2-Cyano-2-propyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropiononitrile-d12; Anastrol-d12; Arimidex-d12; ZD1033-d12
IUPAC Name 2-[3-(2-cyano-1,1,1,3,3,3-hexadeuteriopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-3,3,3-trideuterio-2-(trideuteriomethyl)propanenitrile
Related CAS 120511-73-1 (unlabelled)
Canonical SMILES CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N
InChI InChI=1S/C17H19N5/c1-16(2,9-18)14-5-13(8-22-12-20-11-21-22)6-15(7-14)17(3,4)10-19/h5-7,11-12H,8H2,1-4H3/i1D3,2D3,3D3,4D3
InChI Key YBBLVLTVTVSKRW-MGKWXGLJSA-N
Melting Point 83-85 °C
Purity ≥98%; ≥99% atom D
Solubility Soluble in Chloroform (Slightly), Ethyl Acetate, Methanol (Slightly)
Appearance Pale Yellow Solid
Storage Store at -20°C
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