5-Acetylnaphthalene-1,4-dione

Base Information

• Chemical Name: 5-Acetylnaphthalene-1,4-dione
• CAS No.: 62185-69-7
• Molecular Formula: C12H8O3
• Molecular Weight: 200.194
• ChEMBL ID: CHEMBL3091739
• DSSTox Substance ID: DTXSID00505121
• Nikkaji Number: J672.360H
• Wikidata: Q82360028
• Mol file: 62185-69-7.mol

Synonyms:5-Acetylnaphthalene-1,4-dione;62185-69-7;5-acetyl-1,4-naphthoquinone;CHEMBL3091739;SCHEMBL16072719;DTXSID00505121

Chemical Property of 5-Acetylnaphthalene-1,4-dione

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 200.047344113
• Heavy Atom Count: 15
• Complexity: 354

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC=CC2=C1C(=O)C=CC2=O