Bilobetin

Base Information

• Chemical Name: Bilobetin
• CAS No.: 521-32-4
• Molecular Formula: C31H20 O10
• Molecular Weight: 552.494
• UNII: AJ4UE8X6JZ
• DSSTox Substance ID: DTXSID70200095
• Nikkaji Number: J92.484I
• Wikidata: Q72443484
• Metabolomics Workbench ID: 44590
• ChEMBL ID: CHEMBL378188
• Mol file: 521-32-4.mol

Synonyms:bilobetin

Chemical Property of Bilobetin

Chemical Property:

• Vapor Pressure: 7.34E-32mmHg at 25°C
• Melting Point: 296-298oC
• Boiling Point: 839.6oC at 760 mmHg
• PKA: 6.18±0.40(Predicted)
• Flash Point: 291.9oC
• PSA: 170.80000
• Density: 1.576 g/cm3
• LogP: 5.43700
• Storage Temp.: 2-8°C
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 552.10564683
• Heavy Atom Count: 41
• Complexity: 1060

Purity/Quality:

98%Min ^*data from raw suppliers

Bilobetin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)O