Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.
In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.
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.
Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.
General Information |
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Catalog: BLP-011764 |
CAS: 921943-73-9 |
Molecular Formula: C9H5D3O4 |
Molecular Weight: 183.18 |
Chemical Structure |
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Description | Acetylsalicylic Acid-[d3] is the labelled analogue of Acetylsalicylic Acid, which is a nonsteroidal anti-inflammatory drug (NSAID) used for the treatment of pains and inflammations. |
Synonyms | Acetylsalicylic Acid D3; Aspirin-d3; 2-Acetoxybenzoic Acid-d3; 2-(Acetyloxy)benzoic Acid-d3; 2-(Acetyl-2,2,2-d3-oxy)-benzoic Acid; Acetyl-d3-salicylic Acid; O-Acetylsalicylic Acid-d3; O-Acetoxybenzoic Acid-d3; Acylpyrin-d3 |
IUPAC Name | 2-(2,2,2-trideuterioacetyl)oxybenzoic acid |
Related CAS | 50-78-2 (unlabelled) |
Isomeric SMILES | [2H]C([2H])([2H])C(=O)OC1=CC=CC=C1C(=O)O |
Canonical SMILES | CC(=O)OC1=CC=CC=C1C(=O)O |
InChI | InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/i1D3 |
InChI Key | BSYNRYMUTXBXSQ-FIBGUPNXSA-N |
Melting Point | 134-136 °C |
Purity | ≥97%; ≥97% atom D |
Density | 2.6±0.1 g/cm3 |
Solubility | Soluble in Acetonitrile (Slightly), Chloroform (Slightly), DMSO (Slightly) |
Appearance | White Solid |
Storage | Store at -20°C under inert atmosphere |
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