5,7-dichloro-2H-isoquinolin-1-one

Base Information

• Chemical Name: 5,7-dichloro-2H-isoquinolin-1-one
• CAS No.: 143074-76-4
• Molecular Formula: C9H5Cl2NO
• Molecular Weight: 214.04800
• DSSTox Substance ID: DTXSID801300308
• Mol file: 143074-76-4.mol

Synonyms:143074-76-4;5,7-dichloro-2H-isoquinolin-1-one;5,7-DICHLOROISOQUINOLIN-1(2H)-ONE;5,7-Dichloroisoquinolin-1-ol;DTXSID801300308;5,7-Dichloro-1(2H)-isoquinolinone;AKOS017560720;AB69449;5,7-dichloro-1,2-dihydroisoquinolin-1-one;FT-0775018;EN300-1723799;A921131

Chemical Property of 5,7-dichloro-2H-isoquinolin-1-one

Chemical Property:

• Boiling Point: 461.4±45.0 °C(Predicted)
• PKA: 11.06±0.20(Predicted)
• PSA: 29.43000
• Density: 1.466±0.06 g/cm3(Predicted)
• LogP: 1.62950
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 212.9748192
• Heavy Atom Count: 13
• Complexity: 254

Purity/Quality:

98.5% ^*data from raw suppliers

5,7-Dichloroisoquinolin-1(2H)-one 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CNC(=O)C2=C1C(=CC(=C2)Cl)Cl