Pyrene-1,2-dione

Base Information

• Chemical Name: Pyrene-1,2-dione
• CAS No.: 39461-53-5
• Molecular Formula: C16H8O2
• DSSTox Substance ID: DTXSID10549091
• Wikidata: Q82427990
• Mol file: 39461-53-5.mol

Synonyms:Pyrene-1,2-dione;pyrenchinon;39461-53-5;SCHEMBL309867;DTXSID10549091

Chemical Property of Pyrene-1,2-dione

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 232.052429494
• Heavy Atom Count: 18
• Complexity: 485

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=O)C4=O)C=C2