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Phenylbutazone-[d9]

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Phenylbutazone-[d9]

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General Information
Catalog: BLP-003792
CAS: 1189479-75-1
Molecular Formula: C19H11D9N2O2
Molecular Weight: 317.43

Chemical Structure

Description	Phenylbutazone-[d9], is the labelled analogue of Phenylbutazone, which is a nonsteroidal anti-inflammatory drug for the short-term treatment of pain and fever in animals.
Synonyms	Phenylbutazone D9
IUPAC Name	4-(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)-1,2-diphenylpyrazolidine-3,5-dione
Related CAS	50-33-9 (unlabelled)
Canonical SMILES	CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3
InChI	InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3/i1D3,2D2,3D2,14D2
InChI Key	VYMDGNCVAMGZFE-ABVHXWLASA-N
Melting Point	100-102°C
Purity	96% by CP; 98% atom D
Solubility	Soluble in Acetone, Chloroform, DMSO, Ethyl Acetate, Methanol
Appearance	White to Off-white Solid
Storage	Store at-20°C