Rubraxanthone

Base Information

• Chemical Name: Rubraxanthone
• CAS No.: 65411-01-0
• Molecular Formula: C24H26O6
• Molecular Weight: 410.4596
• DSSTox Substance ID: DTXSID801317779
• Nikkaji Number: J707.084E
• Wikidata: Q27134863
• Metabolomics Workbench ID: 64519
• ChEMBL ID: CHEMBL458846
• Mol file: 65411-01-0.mol

Synonyms:rubra-xanthone;rubraxanthone

Chemical Property of Rubraxanthone

Chemical Property:

• Vapor Pressure: 7.34E-17mmHg at 25°C
• Boiling Point: 637.8°C at 760 mmHg
• Flash Point: 219.4°C
• Density: 1.264g/cm³
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 410.17293854
• Heavy Atom Count: 30
• Complexity: 667

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(=CCC1=C(C(=CC2=C1C(=O)C3=C(C=C(C=C3O2)O)O)O)OC)C)C
• Isomeric SMILES: CC(=CCC/C(=C/CC1=C(C(=CC2=C1C(=O)C3=C(C=C(C=C3O2)O)O)O)OC)/C)C