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Metronidazole-[d4]

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General Information
Catalog: BLP-011608
CAS: 1261392-47-5
Molecular Formula: C6H5D4N3O3
Molecular Weight: 175.18

Chemical Structure

Description	Metronidazole-[d4] is the labelled analogue of Metronidazole, which is a synthetic antibacterial and antiprotozoal agent of the nitroimidazole class. It is a limited spectrum antibiotic that has activity against anaerobic gram-positive and anaerobic gram-negative bacteria.
Synonyms	Metronidazole-(ethylene-d4); 2-Methyl-5-nitro-1H-imidazole-1-(ethanol-d4); Anagiardil-d4; Arilin-d4; Clont-d4; Deflamon-d4; Dentamet Gel-d4; Efloran-d4; Elyzol-d4; Entizol-d4; Flagesol-d4; Flagil-d4; 1-(2-Hydroxyethyl-d4)-2-methyl-5-nitroimidazole; NSC 50364-d4; NSC 69587-d4; Nidazole-d4; Metronidazole-d4
IUPAC Name	1,1,2,2-tetradeuterio-2-(2-methyl-5-nitroimidazol-1-yl)ethanol
Related CAS	443-48-1 (unlabelled) 69198-10-3 (unlabelled hydrochloride) 1261397-74-3 (hydrochloride)
Isomeric SMILES	[2H]C([2H])(C([2H])([2H])O)N1C(=NC=C1[N+](=O)[O-])C
Canonical SMILES	CC1=NC=C(N1CCO)[N+](=O)[O-]
InChI	InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3/i2D2,3D2
InChI Key	VAOCPAMSLUNLGC-RRVWJQJTSA-N
Melting Point	159-161°C
Purity	97% by CP; 98% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Very Slightly)
Appearance	White to Pale Yellow Solid
Storage	Store at 2-8°C