PIPECURONIUM BROMIDE

[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-2,16-bis(4,4-dimethylpiperazin-4-ium-1-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate dibromide

CAS: 52212-02-9

Molecular Formula	`C35H62Br2N4O4`
Molecular Weight	762.7 g/mol
Topological Polar Surface Area	59.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	762.3117
Heavy Atoms	45
Complexity	1060.0

Chemical Identifiers

CAS Number	52212-02-9
SMILES	`CC(=O)OC1CC2CCC3C(C2(CC1N4CC[N+](CC4)(C)C)C)CCC5(C3CC(C5OC(=O)C)N6CC[N+](CC6)(C)C)C.[Br-].[Br-]`
InChIKey	`TXWBOBJCRVVBJF-YTGGZNJNSA-L`

📖 Product Overview

PIPECURONIUM BROMIDE (CAS: 52212-02-9) is a chemical compound with molecular formula C35H62Br2N4O4 and molecular weight 762.7 g/mol. Its IUPAC systematic name is [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-2,16-bis(4,4-dimethylpiperazin-4-ium-1-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate dibromide. Topological Polar Surface Area 59.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 8 Rotatable Bonds 6 Exact Mass 762.3117 Heavy Atoms 45 Complexity 1060.0 InChI Key: TXWBOBJCRVVBJF-YTGGZNJNSA-L. SMILES: CC(=O)OC1CC2CCC3C(C2(CC1N4CC[N+](CC4)(C)C)C)CCC5(C3CC(C5OC(=O)C)N6CC[N+](CC6)(C)C)C.[Br-].[Br-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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