Fremontin

Base Information

• Chemical Name: Fremontin
• CAS No.: 124166-27-4
• Molecular Formula: C20H18 O6
• Molecular Weight: 354.35332
• DSSTox Substance ID: DTXSID30154227
• Wikidata: Q83021381
• Metabolomics Workbench ID: 22431
• ChEMBL ID: CHEMBL523643
• Mol file: 124166-27-4.mol

Synonyms:5'-(alpha,alpha-dimethylallyl)-5,7,2',4'-tetrahydroxyisoflavone;fremontin

Chemical Property of Fremontin

Chemical Property:

• Vapor Pressure: 2.45E-15mmHg at 25°C
• Boiling Point: 607.2°Cat760mmHg
• Flash Point: 219.8°C
• PSA: 111.13000
• Density: 1.41g/cm³
• LogP: 3.74600
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 354.11033829
• Heavy Atom Count: 26
• Complexity: 597

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C=C)C1=C(C=C(C(=C1)C2=COC3=CC(=CC(=C3C2=O)O)O)O)O

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