1-[(Anthracen-9-yl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium iodide

Base Information

• Chemical Name: 1-[(Anthracen-9-yl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium iodide
• CAS No.: 112450-93-8
• Molecular Formula: C27H24NO2.I
• DSSTox Substance ID: DTXSID80548612
• Mol file: 112450-93-8.mol

Synonyms:112450-93-8;DTXSID80548612;1-[(Anthracen-9-yl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium iodide

Chemical Property of 1-[(Anthracen-9-yl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium iodide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 521.08518
• Heavy Atom Count: 31
• Complexity: 545

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)OC)CC3=C4C=CC=CC4=CC5=CC=CC=C53.[I-]