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4-Carboxy Tolbutamide-[d9]

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General Information
Catalog: BLP-011542
CAS: 1184973-50-9
Molecular Formula: C12H7D9N2O5S
Molecular Weight: 309.39

Chemical Structure

Description	4-Carboxy Tolbutamide-[d9] is the labelled analogue of 4-Carboxy Tolbutamide, which is an impurity of Tolbutamide. Tolbutamide is a potassium channel blocker used for the treatment of type 2 diabetes.
Synonyms	4-Carboxy Tolbutamide-d9; 4-[[[(Butyl-d9-amino)carbonyl]amino]sulfonyl]-benzoic Acid; p-[(Butyl-d9-carbamoyl)sulfamoyl]-benzoic Acid; Tolbutamide-d9 Carboxylic Acid; 1-Butyl-d9-3-(p-carboxyphenyl)sulfonylurea; Carboxycarbutamide-d9
IUPAC Name	4-(1,1,2,2,3,3-hexadeuteriobutylcarbamoylsulfamoyl)benzoic acid
Related CAS	2224-10-4 (unlabelled)
Canonical SMILES	CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)O
InChI	InChI=1S/C12H16N2O5S/c1-2-3-8-13-12(17)14-20(18,19)10-6-4-9(5-7-10)11(15)16/h4-7H,2-3,8H2,1H3,(H,15,16)(H2,13,14,17)/i2D2,3D2,8D2
InChI Key	GCMVATDSSHTCOS-KMQVRKNJSA-N
Melting Point	>300°C (dec.)
Purity	95% by HPLC; 98% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly), Water (Slightly)
Appearance	Off-White Solid
Storage	Store at -20°C under inert atmosphere