6-(2-{4-[(2,4-Dioxo-1,3-Thiazolidin-5-Yl)Methyl]Phenoxy}Ethyl)Nicotinic Acid
[CAS# 186751-40-6]

Identification

• Name: 6-(2-{4-[(2,4-Dioxo-1,3-Thiazolidin-5-Yl)Methyl]Phenoxy}Ethyl)Nicotinic Acid
• Synonyms: 5-Desethyl 5-Carboxy Pioglitazone
• Molecular Formula: C₁₈H₁₆N₂O₅S
• Molecular Weight: 372.39
• CAS Registry Number: 186751-40-6
• SMILES: c1cc(ccc1CC2C(=O)NC(=O)S2)OCCc3ccc(cn3)C(=O)O
• InChI: 1S/C18H16N2O5S/c21-16-15(26-18(24)20-16)9-11-1-5-14(6-2-11)25-8-7-13-4-3-12(10-19-13)17(22)23/h1-6,10,15H,7-9H2,(H,22,23)(H,20,21,24)
• InChIKey: SLOBZACXYXBLIT-UHFFFAOYSA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 655.183°C at 760 mmHg (Cal.)
• Flash point: 350.042°C (Cal.)
• Refractive index: 1.648 (Cal.)