tiquizium bromide

(5R,9aR)-7-(dithiophen-2-ylmethylidene)-5-methyl-1,2,3,4,6,8,9,9a-octahydroquinolizin-5-ium bromide

CAS: 71731-58-3

Molecular Formula	`C19H24BrNS2`
Molecular Weight	410.4 g/mol
Topological Polar Surface Area	56.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	409.05334
Heavy Atoms	23
Complexity	429.0

Chemical Identifiers

CAS Number	71731-58-3
SMILES	`C[N+]12CCCCC1CCC(=C(C3=CC=CS3)C4=CC=CS4)C2.[Br-]`
InChIKey	`VKBNGRDAHSELMQ-KYSFMIDTSA-M`

📖 Product Overview

tiquizium bromide (CAS: 71731-58-3) is a chemical compound with molecular formula C19H24BrNS2 and molecular weight 410.4 g/mol. Its IUPAC systematic name is (5R,9aR)-7-(dithiophen-2-ylmethylidene)-5-methyl-1,2,3,4,6,8,9,9a-octahydroquinolizin-5-ium bromide. Topological Polar Surface Area 56.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 409.05334 Heavy Atoms 23 Complexity 429.0 InChI Key: VKBNGRDAHSELMQ-KYSFMIDTSA-M. SMILES: C[N+]12CCCCC1CCC(=C(C3=CC=CS3)C4=CC=CS4)C2.[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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