Benzoic acid, 4,4'-[2,8-bis(1,1-dimethylethyl)-4,10-dihydropyreno[4,5-d:9,10-d']diimidazole-5,11-diyl]bis-

Catalog Number	ACM1184934211-1
CAS	1184934-21-1
Synonyms	4,4'-(2,8-di-tert-butyl-4,10-dihydropyreno[4,5-d:9,10-d']diimidazole-5,11-diyl)dibenzoic acid
IUPAC Name	4-[9,19-ditert-butyl-14-(4-carboxyphenyl)-3,5,13,15-tetrazahexacyclo[9.9.2.02,6.07,22.012,16.017,21]docosa-1(20),2(6),3,7(22),8,10,12(16),13,17(21),18-decaen-4-yl]benzoic acid
Molecular Weight	634.72
Molecular Formula	C40H34N4O4
InChI	InChI=1S/C40H34N4O4/c1-39(2,3)23-15-25-29-26(16-23)32-34(44-36(42-32)20-9-13-22(14-10-20)38(47)48)28-18-24(40(4,5)6)17-27(30(28)29)33-31(25)41-35(43-33)19-7-11-21(12-8-19)37(45)46/h7-18H,1-6H3,(H,41,43)(H,42,44)(H,45,46)(H,47,48)
InChI Key	NHSRBVGDTMJTJK-UHFFFAOYSA-N
Purity	95%
Complexity	1130
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	634.25800558g/mol
Formal Charge	0
Heavy Atom Count	48
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Monoisotopic Mass	634.25800558g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	132Ų