RefChem:1051488
bis[3-(1-methylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
Also Known As: 1,1'-[(2,4-Diphenylcyclobutane-1,3-diyl)bis(carbonyloxypropane-3,1-diyl)]bis(1-methylpyrrolidin-1-ium) diiodide|1,1'-((2,4-Diphenylcyclobutane-1,3-diyl)bis(carbonyloxypropane-3,1-diyl))bis(1-methylpyrrolidin-1-ium) diiodide|bis[3-(1-methylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide|Pyrrolidinium, 1-(3-hydroxypropyl)-1-methyl-, iodide, ester with (cis-1,2,trans-1,3,trans-1,4)-2,4-diphenyl-1,3-cyclobutanedicarboxylic acid (2:1)
| Molecular Formula | C34H48I2N2O4 |
|---|---|
| Molecular Weight | 802.17035 g/mol |
| LogP | -0.8446 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 802.17035 |
| Monoisotopic Mass | 802.17035 |
| Heavy Atoms | 42 |
| Complexity | 742.0 |
Chemical Identifiers
| CAS Number | 4252-07-7 |
|---|---|
| SMILES | C[N+]1(CCCC1)CCCOC(=O)C2C(C(C2C3=CC=CC=C3)C(=O)OCCC[N+]4(CCCC4)C)C5=CC=CC=C5.[I-].[I-] |
| InChIKey | CSXLITRQIWCMEA-UHFFFAOYSA-L |
Product Overview
RefChem:1051488 (CAS 4252-07-7), with molecular formula C34H48I2N2O4 and molecular weight 802.17035 g/mol. IUPAC: bis[3-(1-methylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide.