IN 239

2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]isoquinolin-2-ium dibromide

CAS: 64047-57-0

Molecular Formula	`C17H24Br2N2`
Molecular Weight	416.2 g/mol
Topological Polar Surface Area	3.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	4
Exact Mass	416.02856
Heavy Atoms	21
Complexity	283.0

Chemical Identifiers

CAS Number	64047-57-0
SMILES	`C[N+]1(CCCC1)CCC[N+]2=CC3=CC=CC=C3C=C2.[Br-].[Br-]`
InChIKey	`OUFWPBPWBBMQCV-UHFFFAOYSA-L`

📖 Product Overview

IN 239 (CAS: 64047-57-0) is a chemical compound with molecular formula C17H24Br2N2 and molecular weight 416.2 g/mol. Its IUPAC systematic name is 2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]isoquinolin-2-ium dibromide. Topological Polar Surface Area 3.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 4 Exact Mass 416.02856 Heavy Atoms 21 Complexity 283.0 InChI Key: OUFWPBPWBBMQCV-UHFFFAOYSA-L. SMILES: C[N+]1(CCCC1)CCC[N+]2=CC3=CC=CC=C3C=C2.[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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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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