Cimetidinesulfoxide , ≥99% , 54237-72-8

CAS NO.：54237-72-8

Empirical Formula: C10H16N6OS

Molecular Weight: 268.34

MDL number: MFCD09025940

PRODUCT Properties

• Melting point: >180°C (dec.)
• Boiling point: 594.8±60.0 °C(Predicted)
• Density: 1.39±0.1 g/cm3(Predicted)
• storage temp.: -20°C Freezer
• solubility: DMSO (Slightly, Heated), Methanol (Slightly)
• form: Solid
• pka: 13.38±0.10(Predicted)
• color: White to Off-White
• Major Application: pharmaceutical
• InChI: 1S/C10H16N6OS/c1-8-9(16-7-15-8)5-18(17)4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
• InChIKey: HOJLJLYVNQFCRE-UHFFFAOYSA-N
• SMILES: [S](=O)(CCN\C(=N/C)\NC#N)Cc1nc[nH]c1C

Description and Uses

Cimetidine Sulfoxide (Cimetidine EP Impurity E) is a metabolite of the H2-receptor antagonist Cimetidine (C441650). Cimetidine Sulfoxide is detected in the blood and urine of patients with kidney diseases.

Safety

• Symbol(GHS): GHS06
• Signal word: Danger
• Hazard statements: H301-H311-H331
• Precautionary statements: P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
• WGK Germany: WGK 3
• Storage Class: 11 - Combustible Solids