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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.

Acetylsalicylic Acid-[d4]

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General Information
Catalog: BLP-012816
CAS: 97781-16-3
Molecular Formula: C9H4D4O4
Molecular Weight: 184.18
Chemical Structure
Acetylsalicylic Acid-[d4]
Description Acetylsalicylic Acid-[d4] is the labelled analogue of Acetylsalicylic Acid, which is an antithrombotic, anti-inflammatory, antipyretic analgesic. Acetylsalicylic Acid is an inhibitor of Cox-1 and Cox-2.
Synonyms 2-Acetoxybenzoic-3,4,5,6-d4 Acid; Acetylsalicylic Acid-d4; Acylpyrin-d4; Angettes-d4; Aspro-d4; Aspirin-d4; Acetylsalicylic Acid-d4
IUPAC Name 2-acetyloxy-3,4,5,6-tetradeuteriobenzoic acid
Related CAS 50-78-2 (unlabelled)
Isomeric SMILES [2H]C1=C(C(=C(C(=C1[2H])C(=O)O)OC(=O)C)[2H])[2H]
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)/i2D,3D,4D,5D
InChI Key BSYNRYMUTXBXSQ-QFFDRWTDSA-N
Boiling Point 321.39°C at 760 mmHg
Melting Point 119-132°C
Flash Point 131.156°C
Purity 95% by HPLC; 98% atom D
Density 1.319g/cm3
Solubility Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance White to Off-white Solid
Storage Store at 2-8°C
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