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Diclofenac-[d4] Sodium

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General Information
Catalog: BLP-007350
CAS: 154523-54-3
Molecular Formula: C14H6D4Cl2NO2
Molecular Weight: 322.16

Chemical Structure

Description	Diclofenac-[d4] Sodium, is the labelled analogue of Diclofenac. Diclofenac is a non-selective COX inhibitor with IC50 of 0.5 μg/ml and 0.5 μg/ml for COX-1 and COX-2 in intact cells, respectively.
Synonyms	Diclofenac sodium D4; Sodium [2-(2,6-dichloroanilino)(2H4)phenyl]acetate
IUPAC Name	sodium;2-[2,3,4,5-tetradeuterio-6-(2,6-dichloroanilino)phenyl]acetate
Related CAS	15307-79-6 (unlabelled)
Canonical SMILES	C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl.[Na+]
InChI	InChI=1S/C14H11Cl2NO2.Na/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;/h1-7,17H,8H2,(H,18,19);/q;+1/p-1/i1D,2D,4D,7D;
InChI Key	KPHWPUGNDIVLNH-QOJBZNDNSA-M
Purity	98% by CP; 98% atom D
Solubility	Soluble in DMSO, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C