1,3,6,8-tetrahydroxy-2-[(2S,6S)-6-methyloxan-2-yl]anthracene-9,10-dione

Base Information

• Chemical Name: 1,3,6,8-tetrahydroxy-2-[(2S,6S)-6-methyloxan-2-yl]anthracene-9,10-dione
• CAS No.: 28458-24-4
• Molecular Formula: C20H18 O7
• Molecular Weight: 370.355
• DSSTox Substance ID: DTXSID60951105
• Nikkaji Number: J237.996A
• Wikidata: Q82929349
• Mol file: 28458-24-4.mol

Synonyms:averufanin

Chemical Property of 1,3,6,8-tetrahydroxy-2-[(2S,6S)-6-methyloxan-2-yl]anthracene-9,10-dione

Chemical Property:

• Vapor Pressure: 1.42E-20mmHg at 25°C
• Boiling Point: 705.7°Cat760mmHg
• Flash Point: 257.5°C
• Density: 1.511g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 370.10525291
• Heavy Atom Count: 27
• Complexity: 607

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1CCCC(O1)C2=C(C=C3C(=C2O)C(=O)C4=C(C3=O)C=C(C=C4O)O)O
• Isomeric SMILES: C[C@H]1CCC[C@H](O1)C2=C(C=C3C(=C2O)C(=O)C4=C(C3=O)C=C(C=C4O)O)O