Fremontone

Base Information

• Chemical Name: Fremontone
• CAS No.: 124166-28-5
• Molecular Formula: C25H26 O6
• Molecular Weight: 422.47034
• DSSTox Substance ID: DTXSID90154228
• Nikkaji Number: J494.240J
• Wikidata: Q83021382
• Metabolomics Workbench ID: 22433
• ChEMBL ID: CHEMBL483415
• Mol file: 124166-28-5.mol

Synonyms:3'-(gamma,gamma-dimethylallyl)-5'-(alpha,alpha-dimethylallyl)-5,7,2',4'-tetrahydroxyisoflavone;fremontone

Chemical Property of Fremontone

Chemical Property:

• Vapor Pressure: 2.19E-17mmHg at 25°C
• Boiling Point: 647.9°Cat760mmHg
• Flash Point: 221.3°C
• PSA: 111.13000
• Density: 1.291g/cm³
• LogP: 5.25470
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 422.17293854
• Heavy Atom Count: 31
• Complexity: 749

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCC1=C(C(=CC(=C1O)C(C)(C)C=C)C2=COC3=CC(=CC(=C3C2=O)O)O)O)C