Potassium Ionophore III
[CAS# 99348-39-7]

Identification

• Classification: Analytical chemistry >> Analytical reagent >> Common analytical reagents
• Name: Potassium Ionophore III
• Synonyms: 2-Dodecyl-2-methyl-1,3-propanediyl bis[N-[5′-nitro(benzo-15-crown-5)-4′-yl]carbamate]; BME 44; Potassium ionophore III
• Molecular Formula: C₄₆H₇₀N₄O₁₈
• Molecular Weight: 967.06
• CAS Registry Number: 99348-39-7
• SMILES: [O-][N+](=O)c1cc4OCCOCCOCCOCCOc4cc1NC(=O)OCC(C)(CCCCCCCCCCCC)COC(=O)Nc3c([N+]([O-])=O)cc2OCCOCCOCCOCCOc2c3
• InChI: 1S/C46H70N4O18/c1-3-4-5-6-7-8-9-10-11-12-13-46(2,34-67-44(51)47-36-30-40-42(32-38(36)49(53)54)65-28-24-61-20-16-57-14-18-59-22-26-63-40)35-68-45(52)48-37-31-41-43(33-39(37)50(55)56)66-29-25-62-21-17-58-15-19-60-23-27-64-41/h30-33H,3-29,34-35H2,1-2H3,(H,47,51)(H,48,52)
• InChIKey: ATWXVVNLVXXTQN-UHFFFAOYSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 925.41°C at 760 mmHg (Cal.)
• Flash point: 513.469°C (Cal.)