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5-Hydroxy Dantrolene-[d4]

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General Information
Catalog: BLP-012990
CAS: 1217225-15-4
Molecular Formula: C14H6D4N4O6
Molecular Weight: 334.28

Chemical Structure

Description	5-Hydroxy Dantrolene-[d4] is the labelled analogue of 5-Hydroxy Dantrolene, which is a metabolite of Dantrolene.
Synonyms	5-Hydroxy Dantrolene-d4; 5-Hydroxy-1-[[[5-(4-nitrophenyl-d4)-2-furanyl]methylene]amino]-2,4-imidazolidine-dione
IUPAC Name	5-hydroxy-1-[(E)-[5-(2,3,5,6-tetradeuterio-4-nitrophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione
Related CAS	52130-25-3 (unlabelled)
Canonical SMILES	C1=CC(=CC=C1C2=CC=C(O2)C=NN3C(C(=O)NC3=O)O)[N+](=O)[O-]
InChI	InChI=1S/C14H10N4O6/c19-12-13(20)17(14(21)16-12)15-7-10-5-6-11(24-10)8-1-3-9(4-2-8)18(22)23/h1-7,13,20H,(H,16,19,21)/b15-7+/i1D,2D,3D,4D
InChI Key	PGORTQZSSAZLCK-SXYDXUJESA-N
Melting Point	>229°C (dec.)
Purity	≥95%; ≥98% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly, Heated)
Appearance	Yellow Solid
Storage	Store at 2-8°C under inert atmosphere