Acetylsalicylic Acid-[d4]

Category	Virus Protease
CAS	97781-16-3
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.

Quotation Now

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
Molecular Weight	184.18
Molecular Formula	C9H4D4O4
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
InChIKey	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
Complexity	212
Exact Mass	184.06700
Index Of Refraction	1.551
In Vitro	Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and Metabolic profiles of drugs.
PSA	63.60000
Target	COX; Autophagy; Mitophagy; Virus Protease
XLogP3-AA	1.2