Isoquinoline, 1,2,3,4-tetrahydro-2-(4-(p-chlorophenyl)butyl)-6,7-dimethoxy-1-methyl-, oxalate

2-[4-(4-chlorophenyl)butyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium;2-hydroxy-2-oxoacetate

CAS: 1900-33-0

Molecular Formula	`C24H30ClNO6`
Molecular Weight	463.9 g/mol
Topological Polar Surface Area	100.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	463.17618
Heavy Atoms	32
Complexity	491.0

Chemical Identifiers

CAS Number	1900-33-0
SMILES	`CC1C2=CC(=C(C=C2CC[NH+]1CCCCC3=CC=C(C=C3)Cl)OC)OC.C(=O)(C(=O)[O-])O`
InChIKey	`QMUNKOQUOXYKKW-UHFFFAOYSA-N`

📖 Product Overview

Isoquinoline, 1,2,3,4-tetrahydro-2-(4-(p-chlorophenyl)butyl)-6,7-dimethoxy-1-methyl-, oxalate (CAS: 1900-33-0) is a chemical compound with molecular formula C24H30ClNO6 and molecular weight 463.9 g/mol. Its IUPAC systematic name is 2-[4-(4-chlorophenyl)butyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 100.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 7 Exact Mass 463.17618 Heavy Atoms 32 Complexity 491.0 InChI Key: QMUNKOQUOXYKKW-UHFFFAOYSA-N. SMILES: CC1C2=CC(=C(C=C2CC[NH+]1CCCCC3=CC=C(C=C3)Cl)OC)OC.C(=O)(C(=O)[O-])O.

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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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