RefChem:240731

[(1R,8S)-4-[10-[(1R,8S)-1-(acetyloxymethyl)-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]methyl acetate dibromide

Also Known As: Trachelanthamidinium, 4,4'-decamethylenebis-, dibromide, diacetate|1H-Pyrrolizinium, 4,4'-(1,10-decamethylene)bis(hexahydro-1-hydroxymethyl-, dibromide, diacetate, (1R-cis)-|4,4'-(Decane-1,10-diyl)bis{1-[(acetyloxy)methyl]hexahydro-1H-pyrrolizin-4-ium} dibromide|(1R,1'R,7aS,7'aS)-4,4'-(Decane-1,10-diyl)bis{1-[(acetyloxy)methyl]hexahydro-1H-pyrrolizin-4-ium} dibromide|[(1R,8S)-4-[10-[(1R,8S)-1-(acetyloxymethyl)-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]methyl acetate dibromide

Molecular Formula	C30H54Br2N2O4
Molecular Weight	664.24506 g/mol
LogP	-0.7604
Topological Polar Surface Area	52.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	15
Exact Mass	664.24506
Monoisotopic Mass	666.243
Heavy Atoms	38
Complexity	681.0414

Chemical Identifiers

CAS Number	62960-83-2
SMILES	CC(=O)OC[C@@H]1CC[N+]2([C@H]1CCC2)CCCCCCCCCC[N+]34CCC[C@H]3[C@@H](CC4)COC(=O)C.[Br-].[Br-]