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Hydroxy Tolbutamide-[d9]

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General Information
Catalog: BLP-009709
CAS: 1185112-19-9
Molecular Formula: C12H9D9N2O4S
Molecular Weight: 295.40

Chemical Structure

Description	One of the impurities of Tolbutamide, which is an antidiabetic and often used in veterinary medicine as hypoglycemic agent.
Synonyms	N-(Butylamnocarbonyl)-4-hydroxymethylbenzenesulfonamide-d9; Hydroxytolbutamide-d9; Hydroxymethylcarbutamide-d9; 1-Butyl-3-(p-hydroxymethylphenyl)sulfonylurea-d9
IUPAC Name	1-[4-(hydroxymethyl)phenyl]sulfonyl-3-(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)urea
Related CAS	5719-85-7 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])NC(=O)NS(=O)(=O)C1=CC=C(C=C1)CO
Canonical SMILES	CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)CO
InChI	InChI=1S/C12H18N2O4S/c1-2-3-8-13-12(16)14-19(17,18)11-6-4-10(9-15)5-7-11/h4-7,15H,2-3,8-9H2,1H3,(H2,13,14,16)/i1D3,2D2,3D2,8D2
InChI Key	SJRHYONYKZIRPM-WRMMWXQOSA-N
Melting Point	100-103 °C
Purity	95% by HPLC; 98% atom D
Appearance	White to Off-White Solid