AC1MIL2C
[(1R,8R)-4-[10-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
Also Known As: Lindelofidinium, 4,4'-(1,10-decamethylene)bis-, dibromide|1H-Pyrrolizinium, 4,4'-(1,10-decamethylene)bis(hexahydro-1-hydroxymethyl-, dibromide, (1R-trans)-|[(1R,8R)-4-[10-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide|1H-Pyrrolizinium, 4,4'-(1,10-decamethylene)bis(hexahydro-1-hydroxymethyl-, dibromide, (1R-cis)-
| Molecular Formula | C26H50Br2N2O2 |
|---|---|
| Molecular Weight | 580.2239 g/mol |
| LogP | -1.902 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 580.2239 |
| Monoisotopic Mass | 582.22186 |
| Heavy Atoms | 32 |
| Complexity | 493.95627 |
Chemical Identifiers
| CAS Number | 62989-85-9 |
|---|---|
| SMILES | C1C[C@@H]2[C@@H](CC[N+]2(C1)CCCCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)CO)CO.[Br-].[Br-] |
Product Overview
AC1MIL2C (CAS 62989-85-9), with molecular formula C26H50Br2N2O2 and molecular weight 580.2239 g/mol. IUPAC: [(1R,8R)-4-[10-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide.
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