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5-Methylisoxazole-3-carboxylic Acid-[d4]

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General Information
Catalog: BLP-003068
CAS: 1267623-84-6
Molecular Formula: C5HD4NO3
Molecular Weight: 131.12

Chemical Structure

Description	5-Methylisoxazole-3-carboxylic Acid-[d4] is a labelled metabolite of UTL-5b, which is a structural analogue of the anti-arthritic drug, Leflunomide.
Synonyms	5-(Methyl-d3)-3-isoxazole-4-d-carboxylic Acid; 3-Carboxy-5-methylisoxazole-d4; 5-Methyl-3-isoxazolecarboxylic-d4 Acid
IUPAC Name	4-deuterio-5-(trideuteriomethyl)-1,2-oxazole-3-carboxylic acid
Related CAS	3405-77-4 (unlabelled)
Canonical SMILES	CC1=CC(=NO1)C(=O)O
InChI	InChI=1S/C5H5NO3/c1-3-2-4(5(7)8)6-9-3/h2H,1H3,(H,7,8)/i1D3,2D
InChI Key	BNMPIJWVMVNSRD-MZCSYVLQSA-N
Purity	> 98%
Solubility	Soluble in Dichloromethane, Ethyl Acetate, Methanol
Appearance	Yellow Solid