4-Hydroxytolbutamide , ≥98%(HPLC) , 5719-85-7

Synonym(s):
N-(Butylaminocarbonyl)-4-hydroxymethylbenzenesulfonamide

CAS NO.：5719-85-7

Empirical Formula: C12H18N2O4S

Molecular Weight: 286.35

MDL number: MFCD00144466

EINECS: 200-835-2

PRODUCT Properties

• Melting point: 100-102 °C
• Density: 1.268±0.06 g/cm3(Predicted)
• Flash point: 2℃
• storage temp.: 2-8°C
• solubility: ethanol: 12 mg/mL
• pka: 4.96±0.10(Predicted)
• form: Solid
• color: white
• 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)
• InChIKey: SJRHYONYKZIRPM-UHFFFAOYSA-N
• SMILES: CCCCNC(=O)NS(=O)(=O)c1ccc(CO)cc1

Description and Uses

4-hydroxy Tolbutamide is a cytochrome P450 2C8 (CYP2C8) and CYP2C9 metabolite of tolbutamide, a first-generation potassium channel blocker. Tolbutamide 4-hydroxylation is an often used probe reaction in the pharmaceutical industry for the characterization of CYP2C8 and CYP2C9 involvement in the metabolism of clinical drugs.

4-Hydroxytolbutamide has been used as a standard to assay the fungal biotransformation of tolbutamide to 4′-hydroxytolbutamide.

Safety

• Symbol(GHS): GHS02,GHS07
• Signal word: Danger
• Hazard statements: H225-H302+H312+H332-H319
• Precautionary statements: P210-P261-P302+P352+P312-P304+P340+P312-P337+P313-P403+P235
• PPE: Eyeshields, Gloves, type N95 (US)
• Hazard Codes: F,Xn
• Risk Statements: 11-20/21/22-36
• Safety Statements: 16-36/37-24/25
• RIDADR: UN 1648 3 / PGII
• WGK Germany: 3
• HS Code: 29350090
• Storage Class: 11 - Combustible Solids