4-Methyl-2-(1-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-4-Piperidinyl)-1,3-Thiazole-5-Carboxylic Acid
[CAS# 216955-61-2]

Identification

• Name: 4-Methyl-2-(1-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-4-Piperidinyl)-1,3-Thiazole-5-Carboxylic Acid
• Synonyms: 2-[1-(tert-Butoxycarbonyl)piperidin-4-yl]-4-methyl-1,3-thiazole-5-carboxylic acid; 2-[1-(tert-Butoxycarbonyl)piperidin-4-yl]-5-carboxy-4-methyl-1,3-thiazole; 2-[1-(tert-Butoxycarbonyl)piperidin-4-yl]-5-carboxy-4-methyl-1,3-thiazole, tert-Butyl 4-(5-carboxy-4-methyl-1,3-thiazol-2-yl)piperidin-1-carboxylate
• Molecular Formula: C₁₅H₂₂N₂O₄S
• Molecular Weight: 326.41
• CAS Registry Number: 216955-61-2
• SMILES: O=C(OC(C)(C)C)N2CCC(c1nc(c(s1)C(=O)O)C)CC2
• InChI: 1S/C15H22N2O4S/c1-9-11(13(18)19)22-12(16-9)10-5-7-17(8-6-10)14(20)21-15(2,3)4/h10H,5-8H2,1-4H3,(H,18,19)
• InChIKey: XDKKXEMKXSGKOR-UHFFFAOYSA-N

Properties

• Density: 1.254g/cm³ (Cal.)
• Boiling point: 481.328°C at 760 mmHg (Cal.)
• Flash point: 244.899°C (Cal.)
• Refractive index: 1.559 (Cal.)

Safety Data

• Safety Description: Harmful/Irritant/Keep Cold