Pyrido[2,1-a]isoquinolin-5-ium

Base Information

• Chemical Name: Pyrido[2,1-a]isoquinolin-5-ium
• CAS No.: 231-02-7
• Molecular Formula: C13H10N
• Molecular Weight: 0
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID00494006
• Nikkaji Number: J79.529A
• Mol file: 231-02-7.mol

Synonyms:231-02-7;Pyrido[2,1-a]isoquinolin-5-ium;SCHEMBL610868;DTXSID00494006

Chemical Property of Pyrido[2,1-a]isoquinolin-5-ium

Chemical Property:

• PSA: 4.10000
• LogP: 2.57850
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 180.081324323
• Heavy Atom Count: 14
• Complexity: 201

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C[N+]3=CC=CC=C23