Isoquinoline, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-2-methyl-6,7,8-trimethoxy-, hydrobromide

1-[2-(4-chlorophenyl)ethyl]-6,7,8-trimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium bromide

CAS: 63937-86-0

Molecular Formula	`C21H27BrClNO3`
Molecular Weight	456.8 g/mol
Topological Polar Surface Area	32.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	455.08627
Heavy Atoms	27
Complexity	429.0

Chemical Identifiers

CAS Number	63937-86-0
SMILES	`C[NH+]1CCC2=CC(=C(C(=C2C1CCC3=CC=C(C=C3)Cl)OC)OC)OC.[Br-]`
InChIKey	`CNWUDWCPTYHKSL-UHFFFAOYSA-N`

📖 Product Overview

Isoquinoline, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-2-methyl-6,7,8-trimethoxy-, hydrobromide (CAS: 63937-86-0) is a chemical compound with molecular formula C21H27BrClNO3 and molecular weight 456.8 g/mol. Its IUPAC systematic name is 1-[2-(4-chlorophenyl)ethyl]-6,7,8-trimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium bromide. Topological Polar Surface Area 32.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 455.08627 Heavy Atoms 27 Complexity 429.0 InChI Key: CNWUDWCPTYHKSL-UHFFFAOYSA-N. SMILES: C[NH+]1CCC2=CC(=C(C(=C2C1CCC3=CC=C(C=C3)Cl)OC)OC)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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