4-methoxy-6-methyl-7-(3-phenylpropyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride

CAS: 66902-34-9

Molecular Formula	`C21H26ClNO3`
Molecular Weight	375.9 g/mol
Topological Polar Surface Area	32.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	375.16013
Heavy Atoms	26
Complexity	425.0

Chemical Identifiers

CAS Number	66902-34-9
SMILES	`C[NH+]1CC2=C(C3=C(C=C2CC1CCCC4=CC=CC=C4)OCO3)OC.[Cl-]`
InChIKey	`IKJDQKMKZXMARR-UHFFFAOYSA-N`

📖 Product Overview

4-methoxy-6-methyl-7-(3-phenylpropyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride (CAS: 66902-34-9) is a chemical compound with molecular formula C21H26ClNO3 and molecular weight 375.9 g/mol. Its IUPAC systematic name is 4-methoxy-6-methyl-7-(3-phenylpropyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride. Topological Polar Surface Area 32.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 375.16013 Heavy Atoms 26 Complexity 425.0 InChI Key: IKJDQKMKZXMARR-UHFFFAOYSA-N. SMILES: C[NH+]1CC2=C(C3=C(C=C2CC1CCCC4=CC=CC=C4)OCO3)OC.[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 4-methoxy-6-methyl-7-(3-phenylpropyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride.

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