1,4,7,10,13-Pentaoxacyclopentadecane - 4-(2-methyl-2-propanyl)pentacyclo[19.3.1.1^3,7.1^9,13.1^15,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene (1:1)
[CAS# 99314-01-9]

Identification

• Name: 1,4,7,10,13-Pentaoxacyclopentadecane - 4-(2-methyl-2-propanyl)pentacyclo[19.3.1.1^3,7.1^9,13.1^15,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene (1:1)
• Synonyms: 4-TERT-BUTYL-CALIX[4]ARENE-CROWN-5-COMPLEX
• Molecular Formula: C₄₂H₅₂O₅
• Molecular Weight: 636.86
• CAS Registry Number: 99314-01-9
• SMILES: CC(C)(C)C1=C2CC3=CC=CC(=C3)CC4=CC=CC(=C4)CC5=CC(=CC=C5)CC(=C2)C=C1.C1COCCOCCOCCOCCO1
• InChI: 1S/C32H32.C10H20O5/c1-32(2,3)31-14-13-29-20-27-10-5-9-25(18-27)16-23-7-4-8-24(15-23)17-26-11-6-12-28(19-26)21-30(31)22-29;1-2-12-5-6-14-9-10-15-8-7-13-4-3-11-1/h4-15,18-19,22H,16-17,20-21H2,1-3H3;1-10H2
• InChIKey: YMSFEKSEHZCCIJ-UHFFFAOYSA-N