CAS 70234-85-4

()-1,2,3,4,5,6,7,8-octahydro-1-(4-methoxybenzyl)isoquinolinium chloride

Description:

()-1,2,3,4,5,6,7,8-octahydro-1-(4-methoxybenzyl)isoquinolinium chloride, with the CAS number 70234-85-4, is a chemical compound characterized by its isoquinoline structure, which is a bicyclic compound featuring a fused benzene and pyridine ring. This substance is typically a quaternary ammonium salt, indicated by the presence of the chloride ion, which contributes to its solubility in polar solvents. The methoxybenzyl group enhances its lipophilicity, potentially influencing its biological activity and interaction with various receptors. The octahydro configuration suggests that the compound is saturated, which may affect its reactivity and stability. This compound may exhibit pharmacological properties, making it of interest in medicinal chemistry, particularly in the development of therapeutic agents. Its specific characteristics, such as melting point, boiling point, and spectral data, would require empirical measurement or literature reference for precise values. Overall, this compound's unique structural features contribute to its potential applications in various fields, including pharmaceuticals and organic synthesis.

Formula: C₁₇H₂₄ClNO

InChI: InChI=1S/C17H23NO.ClH/c1-19-15-8-6-13(7-9-15)12-17-16-5-3-2-4-14(16)10-11-18-17;/h6-9,17-18H,2-5,10-12H2,1H3;1H

InChI key: InChIKey=KPOHPPSNWPXYNT-UHFFFAOYSA-N

SMILES: C(C1C2=C(CCN1)CCCC2)C3=CC=C(OC)C=C3.Cl

Synonyms:

• (1)-1,2,3,4,5,6,7,8-Octahydro-1-(4-methoxybenzyl)isoquinolinium chloride
• (±)-1-(4-Methoxybenzyl)-1,2,3,4,5,6,7,8-octahydroisoquinoline hydrochloride
• Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-[(4-methoxyphenyl)methyl]-, hydrochloride
• Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-[(4-methoxyphenyl)methyl]-, hydrochloride (1:1)
• (±)-1,2,3,4,5,6,7,8-octahydro-1-(4-methoxybenzyl)isoquinolinium chloride
• 1-(4-Methoxy-benzyl)-1,2,3,4,5,6,7,8-octahydro-isoquinoline hydrochloride
• 1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline hydrochloride