RefChem:378965

diethyl-methyl-[2-(1-methyl-1-azoniabicyclo[2.2.2]octane-3-carbonyl)oxyethyl]azanium diiodide

Also Known As: Of-1591|Quinuclidinium, 3-carboxy-1-methyl-, iodide, ester with diethyl(2-hydroxyethyl)methylammonium iodide|3-({2-[diethyl(methyl)ammonio]ethoxy}carbonyl)-1-methyl-1-azoniabicyclo[2.2.2]octane diiodide|1-AZONIABICYCLO[2.2.2]OCTANE,3-[[2-(DIETHYLMETHYLAMMONIO)ETHOXY]CARBONYL]-1-METHYL-, IODIDE (1:2)|1-Azoniabicyclo[2.2.2]octane,3-[[2-(diethylmethylammonio)ethoxy]carbonyl]-1-methyl-,iodide(1:2)|3-({2-[Diethyl(methyl)azaniumyl]ethoxy}carbonyl)-1-methyl-1-azabicyclo[2.2.2]octan-1-ium diiodide|diethyl-methyl-[2-(1-methyl-1-azoniabicyclo[2.2.2]octane-3-carbonyl)oxyethyl]azanium diiodide

Molecular Formula	C16H32I2N2O2
Molecular Weight	538.0553 g/mol
LogP	-4.49
Topological Polar Surface Area	26.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	6
Exact Mass	538.0553
Heavy Atoms	22
Complexity	354.1

Chemical Identifiers

CAS Number	13435-69-3
SMILES	CC[N+](C)(CC)CCOC(=O)C1C[N+]2(CCC1CC2)C.[I-].[I-]