ISOQUINOLINE, 3,4-DIHYDRO-3-(o-CHLOROBENZYL)-6,7-DIMETHOXY-, HYDROBROMIDE

3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium bromide

CAS: 57543-14-3

Molecular Formula	`C18H19BrClNO2`
Molecular Weight	396.7 g/mol
Topological Polar Surface Area	32.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	395.02878
Heavy Atoms	23
Complexity	389.0

Chemical Identifiers

CAS Number	57543-14-3
SMILES	`COC1=C(C=C2C=[NH+]C(CC2=C1)CC3=CC=CC=C3Cl)OC.[Br-]`
InChIKey	`WHONTKHOMUSXEQ-UHFFFAOYSA-N`

📖 Product Overview

ISOQUINOLINE, 3,4-DIHYDRO-3-(o-CHLOROBENZYL)-6,7-DIMETHOXY-, HYDROBROMIDE (CAS: 57543-14-3) is a chemical compound with molecular formula C18H19BrClNO2 and molecular weight 396.7 g/mol. Its IUPAC systematic name is 3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium bromide. Topological Polar Surface Area 32.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 395.02878 Heavy Atoms 23 Complexity 389.0 InChI Key: WHONTKHOMUSXEQ-UHFFFAOYSA-N. SMILES: COC1=C(C=C2C=[NH+]C(CC2=C1)CC3=CC=CC=C3Cl)OC.[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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📚 Academic Support

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