Calcium Ionophore VI
[CAS# 171979-66-1]

Identification

• Name: Calcium Ionophore VI
• Synonyms: Calcium ionophore VI; tert-Butyl-calix[4]arene tetrakis[2-(diphenylphosphoryl)ethyl ether]
• Molecular Formula: C₁₀₀H₁₀₈O₈P₄
• Molecular Weight: 1561.82
• CAS Registry Number: 171979-66-1
• SMILES: O=P(c1ccccc1)(c2ccccc2)CCOc3c%13cc(cc3Cc6cc(cc(c6OCCP(=O)(c4ccccc4)c5ccccc5)Cc9c(OCCP(=O)(c7ccccc7)c8ccccc8)c(cc(c9)C(C)(C)C)Cc%12c(OCCP(=O)(c%10ccccc%10)c%11ccccc%11)c(cc(c%12)C(C)(C)C)C%13)C(C)(C)C)C(C)(C)C
• InChI: 1S/C100H108O8P4/c1-97(2,3)81-65-73-61-75-67-82(98(4,5)6)69-77(94(75)106-54-58-110(102,87-41-25-15-26-42-87)88-43-27-16-28-44-88)63-79-71-84(100(10,11)12)72-80(96(79)108-56-60-112(104,91-49-33-19-34-50-91)92-51-35-20-36-52-92)64-78-70-83(99(7,8)9)68-76(95(78)107-55-59-111(103,89-45-29-17-30-46-89)90-47-31-18-32-48-90)62-74(66-81)93(73)105-53-57-109(101,85-37-21-13-22-38-85)86-39-23-14-24-40-86/h13-52,65-72H,53-64H2,1-12H3
• InChIKey: JTLQADIQVNKIFC-UHFFFAOYSA-N

Properties

• Density: 1.221g/cm³ (Cal.)
• Refractive index: 1.638 (Cal.)