Diplacin
4-[2-[3-[2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]ethoxy]phenoxy]ethyl]-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-ol dichloride
Also Known As: Diplacin|diplacine|Diplacine Dichloride|diplatsin|6705AD|4-[2-[3-[2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]ethoxy]phenoxy]ethyl]-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-ol;dichloride|1H-Pyrrolizinium, 4,4'-[1,3-phenylenebis(oxy-2,1-ethanediyl)]bis[hexahydro-1-hydroxy-7-(hydroxymethyl)-, dichloride (9CI)|1-hydroxy-4-[2-(3-{2-[1-hydroxy-7-(hydroxymethyl)-hexahydro-1H-pyrrolizin-4-ium-4-yl]ethoxy}phenoxy)ethyl]-7-(hydroxymethyl)-hexahydro-1H-pyrrolizin-4-ium dichloride|1H-Pyrrolizinium, 4,4'-(m-phenylenebis(oxyethylene))bis(hexahydro-1-hydroxy-7-(hydroxymethyl)-, dichloride|4,4'-[benzene-1,3-diylbis(oxyethane-2,1-diyl)]bis[1-hydroxy-7-(hydroxymethyl)hexahydro-1h-pyrrolizinium] dichloride|1H-Pyrrolizinium,4,4'-[1,3-phenylenebis(oxy-2,1-ethanediyl)]bis[hexahydro-1-hydroxy-7-(hydroxymethyl)-,dichloride (9CI)|4,4'-[1,3-Phenylenebis(oxy-2,1-ethanediyl)]bis[1-h ydroxy-7-(hydroxymethyl)hexahydro-1H-pyrroliziniu|4,4'-(2,2'-(1,3-Phenylenebis(oxy))bis(ethane-2,1-diyl))bis-(1-hydroxy-7-(hydroxymethyl)octahydropyrrolizinium) chloride|4,4'-[1,3-Phenylenebis(oxy-2,1-ethanediyl)]bis[1-h ydroxy-7-(hydroxymethyl)hexahydro-1H-pyrroliziniu|4,4'-[1,3-phenylenebis(oxy-2,1-ethanediyl)]bis[1-hydroxy-7-(hydroxymethyl)hexahydro-1h-pyrrolizinium|4,4'-[1,3-phenylenebis(oxy-2,1-ethanediyl)]bis[1-hydroxy-7-(hydroxymethyl)hexahydro-1H-pyrrolizinium] dichloride|4,4'-[1,3-Phenylenebis(oxyethane-2,1-diyl)]bis[1-hydroxy-7-(hydroxymethyl)hexahydro-1H-pyrrolizin-4-ium] dichloride|4,4'-[1,3-phenylenebis(oxyethane-2,1-diyl)]bis[1-hydroxy-7-(hydroxymethyl)hexahydro-1H-pyrrolizinium] dichloride|4-[2-(3-{2-[1-hydroxy-7-(hydroxymethyl)perhydropyrrolizin-4-yl]ethoxy}phenoxy) ethyl]-7-(hydroxymethyl)perhydropyrrolizin-1-ol, chloride, chloride|4-[2-[3-[2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]ethoxy]phenoxy]ethyl]-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-ol dichloride
| Molecular Formula | C26H42Cl2N2O6 |
|---|---|
| Molecular Weight | 548.242 g/mol |
| LogP | -5.6234 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 548.242 |
| Monoisotopic Mass | 548.242 |
| Heavy Atoms | 36 |
| Complexity | 630.0 |
Chemical Identifiers
| CAS Number | 863-83-2 |
|---|---|
| SMILES | C1C[N+]2(CCC(C2C1CO)O)CCOC3=CC(=CC=C3)OCC[N+]45CCC(C4C(CC5)O)CO.[Cl-].[Cl-] |
| InChIKey | RUNACLFUDAJMTR-UHFFFAOYSA-L |
Product Overview
Diplacin (CAS 863-83-2), with molecular formula C26H42Cl2N2O6 and molecular weight 548.242 g/mol. IUPAC: 4-[2-[3-[2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]ethoxy]phenoxy]ethyl]-7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-ol dichloride.
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