3-Azabicyclo[4.2.0]octa-1(6),4-dien-2-one

Base Information

• Chemical Name: 3-Azabicyclo[4.2.0]octa-1(6),4-dien-2-one
• CAS No.: 82450-02-0
• Molecular Formula: C₇H₇NO
• Molecular Weight: 121.139
• DSSTox Substance ID: DTXSID30513739
• Wikidata: Q82373683
• Mol file: 82450-02-0.mol

Synonyms:3-AZABICYCLO[4.2.0]OCTA-1(6),4-DIEN-2-ONE;82450-02-0;DTXSID30513739;AKOS006356425

Chemical Property of 3-Azabicyclo[4.2.0]octa-1(6),4-dien-2-one

Chemical Property:

• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 121.052763847
• Heavy Atom Count: 9
• Complexity: 225

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC2=C1C=CNC2=O