Calixarene

methyl 2-[[5,11,17,23-tetratert-butyl-26,27,28-tris(2-methoxy-2-oxoethoxy)-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]acetate

Also Known As: Calixarene|Calixarenes|Calix(n)Arenes|2-Formylcinnamic acid|6354-EP2315303A1|6354-EP2380872A1|p-tert-Butylcalx[4]arene tertrakis(methyl acetate)|Acetic acid, 2,2',2'',2'''-((25,26,27,28-tetrakis(1,1-dimethylethyl)pentacyclo(19.3.1.1(3,7).1(9,13).1(15,19))octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-5,11,17,23-tetrayl)tetrakis(oxy))tetrakis-, tetramethyl ester|methyl 2-[[5,11,17,23-tetratert-butyl-26,27,28-tris(2-methoxy-2-oxoethoxy)-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]acetate|[[5,11,17,23-Tetra-tert-butylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayl]tetrakisoxy]tetrakis(acetic acid methyl) ester|[[5,11,17,23-Tetra-tert-butylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayl]tetraoxy]tetraacetic acid tetramethyl ester|[[5,11,17,23-Tetratert-butylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayl]tetraoxy]tetrakis(acetic acid methyl) ester|2,2 ,2 ,2 -[5,11,17,23-Tetra-tert-butylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayltetraoxy]tetrakis(acetic acid methyl) ester|5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrakis(2-methoxy-2-oxoethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene|5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrakis(2-oxo-2-methoxyethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene|5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrakis(methoxycarbonylmethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene|methyl 2-{[5,11,17,23-tetra-tert-butyl-26,27,28-tris(2-methoxy-2-oxoethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaen-25-yl]oxy}acetate|Tetramethyl 2,2',2'',2'''-((15,35,55,75-tetra-tert-butyl-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,32,52,72-tetrayl)tetrakis(oxy))tetraacetate|Tetramethyl 2,2',2'',2'''-{[1~5~,3~5~,5~5~,7~5~-tetra-tert-butyl-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-1~2~,3~2~,5~2~,7~2~-tetrayl]tetrakis(oxy)}tetraacetate

Molecular Formula	C56H72O12
Molecular Weight	936.5024 g/mol
LogP	9.7604
Topological Polar Surface Area	142.12 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	12
Rotatable Bonds	12
Exact Mass	936.5024
Monoisotopic Mass	936.5024
Heavy Atoms	68
Complexity	2078.082

Chemical Identifiers

CAS Number	97600-40-3
SMILES	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3OCC(=O)OC)CC4=CC(=CC(=C4OCC(=O)OC)CC5=C(C(=CC(=C5)C(C)(C)C)C2)OCC(=O)OC)C(C)(C)C)C(C)(C)C)OCC(=O)OC