1,4-Naphthalenedione, 8-(acetyloxy)-2-bromo-

Base Information

• Chemical Name: 1,4-Naphthalenedione, 8-(acetyloxy)-2-bromo-
• CAS No.: 77197-58-1
• Molecular Formula: C12H7BrO4
• Molecular Weight: 295.089
• DSSTox Substance ID: DTXSID60446586
• Nikkaji Number: J403.488K
• Wikidata: Q82265291
• ChEMBL ID: CHEMBL4167563
• Mol file: 77197-58-1.mol

Synonyms:77197-58-1;1,4-Naphthalenedione, 8-(acetyloxy)-2-bromo-;CHEMBL4167563;SCHEMBL10391092;DTXSID60446586;2-Bromo-8-acetoxy-1,4-naphthoquinone;3-bromo-5-acetoxy-1,4-naphthoquinone;7-Bromo-5,8-dioxo-5,8-dihydronaphthalen-1-yl acetate

Chemical Property of 1,4-Naphthalenedione, 8-(acetyloxy)-2-bromo-

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 293.95277
• Heavy Atom Count: 17
• Complexity: 413

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OC1=CC=CC2=C1C(=O)C(=CC2=O)Br