1,2-Dihydro-2-methyl-1-oxoisoquinoline-7-carbonitrile

Base Information

• Chemical Name: 1,2-Dihydro-2-methyl-1-oxoisoquinoline-7-carbonitrile
• CAS No.: 1374652-68-2
• Molecular Formula: C11H8N2O
• Molecular Weight: 184.19
• DSSTox Substance ID: DTXSID501203454
• Mol file: 1374652-68-2.mol

Synonyms:1374652-68-2;1,2-dihydro-2-methyl-1-oxoisoquinoline-7-carbonitrile;2-methyl-1-oxoisoquinoline-7-carbonitrile;2-dihydro-2-Methyl-1-oxoisoquinoline-7-carbonitrile;2-Methyl-1-oxo-1,2-dihydroisoquinoline-7-carbonitrile;DTXSID501203454;7-Isoquinolinecarbonitrile, 1,2-dihydro-2-methyl-1-oxo-

Chemical Property of 1,2-Dihydro-2-methyl-1-oxoisoquinoline-7-carbonitrile

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 184.063662883
• Heavy Atom Count: 14
• Complexity: 325

Purity/Quality:

98.5% ^*data from raw suppliers

1,2-Dihydro-2-methyl-1-oxoisoquinoline-7-carbonitrile 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C=CC2=C(C1=O)C=C(C=C2)C#N