1-[(3-Methylphenyl)methyl]isoquinoline structure

1-[(3-Methylphenyl)methyl]isoquinoline

1-[(3-methylphenyl)methyl]isoquinoline

Also Known As: 1-(3-methylbenzyl)isoquinoline|1-[(3-methylphenyl)methyl]isoquinoline|Isoquinoline, 1-[(3-methylphenyl)methyl]-|J3.448.650F

CAS: 98237-16-2
Molecular Formula C17H15N
Molecular Weight 233.12045 g/mol
LogP 4.13402
Topological Polar Surface Area 12.89 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
Rotatable Bonds 2
Exact Mass 233.12045
Monoisotopic Mass 233.12045
Heavy Atoms 18
Complexity 680.5147

Chemical Identifiers

CAS Number 98237-16-2
SMILES CC1=CC(=CC=C1)CC2=NC=CC3=CC=CC=C32

Product Overview

1-[(3-Methylphenyl)methyl]isoquinoline (CAS 98237-16-2), with molecular formula C17H15N and molecular weight 233.12045 g/mol. IUPAC: 1-[(3-methylphenyl)methyl]isoquinoline.

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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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