3,3'-Methylenebis[1-(2,6-diisopropylphenyl)-3-imidazolium bromide]

Catalog Number	ACM889617361-1
CAS	889617-36-1
Synonyms	1-[2,6-Di(propan-2-yl)phenyl]-3-[[3-[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-1-yl]methyl]imidazol-3-ium;dibromide
IUPAC Name	1-[2,6-di(propan-2-yl)phenyl]-3-[[3-[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-1-yl]methyl]imidazol-3-ium;dibromide
Molecular Weight	630.50
Molecular Formula	C31H42Br2N4
Canonical SMILES	CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2)C[N+]3=CN(C=C3)C4=C(C=CC=C4C(C)C)C(C)C.[Br-].[Br-];
InChI	ZZGWEIDPDBDPOH-UHFFFAOYSA-L
InChI Key	InChI=1S/C31H42N4.2BrH/c1-22(2)26-11-9-12-27(23(3)4)30(26)34-17-15-32(20-34)19-33-16-18-35(21-33)31-28(24(5)6)13-10-14-29(31)25(7)8;;/h9-18,20-25H,19H2,1-8H3;2*1H/q+2;;/p-2
Melting Point	277 °C(lit.)
Purity	98%+
Complexity	560
Covalently-Bonded Unit Count	3
Exact Mass	630.176g/mol
Heavy Atom Count	37
Isomeric SMILES	CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2)C[N+]3=CN(C=C3)C4=C(C=CC=C4C(C)C)C(C)C.[Br-].[Br-]
Monoisotopic Mass	628.178g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	17.6A^2