Diosquinone

Base Information

• Chemical Name: Diosquinone
• CAS No.: 50886-69-6
• Molecular Formula: C₂₂H₁₄O₇
• Molecular Weight: 390.349
• NSC Number: 342731
• DSSTox Substance ID: DTXSID00965125
• Nikkaji Number: J10.266K
• Wikidata: Q82947305
• ChEMBL ID: CHEMBL1984064
• Mol file: 50886-69-6.mol

Synonyms:diosquinone

Chemical Property of Diosquinone

Chemical Property:

• Vapor Pressure: 4.16E-24mmHg at 25°C
• Boiling Point: 763°Cat760mmHg
• Flash Point: 277.5°C
• PSA: 121.27000
• Density: 1.601g/cm³
• LogP: 2.32360
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 390.07395278
• Heavy Atom Count: 29
• Complexity: 844

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC2=C(C(=C1)O)C(=O)C=C(C2=O)C3=C(C4=C(C=C3C)C(=O)C5C(C4=O)O5)O