(S)-[(2R)-5-ethenyl-1-methyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol chloride

CAS: 63717-11-3

Molecular Formula	`C21H27ClN2O2`
Molecular Weight	374.9 g/mol
Topological Polar Surface Area	42.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	374.17612
Heavy Atoms	26
Complexity	498.0

Chemical Identifiers

CAS Number	63717-11-3
SMILES	`C[N+]12CCC(CC1C(C3=C4C=C(C=CC4=NC=C3)OC)O)C(C2)C=C.[Cl-]`
InChIKey	`JDGBARYFQADTHZ-KCWPWBDNSA-M`

📖 Product Overview

(S)-[(2R)-5-ethenyl-1-methyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol chloride (CAS: 63717-11-3) is a chemical compound with molecular formula C21H27ClN2O2 and molecular weight 374.9 g/mol. Its IUPAC systematic name is (S)-[(2R)-5-ethenyl-1-methyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol chloride. Topological Polar Surface Area 42.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 374.17612 Heavy Atoms 26 Complexity 498.0 InChI Key: JDGBARYFQADTHZ-KCWPWBDNSA-M. SMILES: C[N+]12CCC(CC1C(C3=C4C=C(C=CC4=NC=C3)OC)O)C(C2)C=C.[Cl-].

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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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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for (S)-[(2R)-5-ethenyl-1-methyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol chloride.

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