Dihydrobiochanin A

Base Information

• Chemical Name: Dihydrobiochanin A
• CAS No.: 83920-62-1
• Molecular Formula: C16H14O5
• Molecular Weight: 286.284
• DSSTox Substance ID: DTXSID00331442
• Nikkaji Number: J303.867J
• Wikidata: Q27098201
• Metabolomics Workbench ID: 22612
• ChEMBL ID: CHEMBL2230142

Synonyms:Dihydrobiochanin A;83920-62-1;2,3-Dihydrobiochanin A;CHEBI:15712;5,7-dihydroxy-3-(4-methoxyphenyl)chroman-4-one;Biochanin A,(S);CHEMBL2230142;Dihydrogenistein 4'-methyl ether;DTXSID00331442;5,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydrochromen-4-one;LMPK12050475;C02675;Q27098201;5,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one

Chemical Property of Dihydrobiochanin A

Chemical Property:

• Melting Point: 173-174 °C(Solv: ethanol (64-17-5))
• Boiling Point: 539.6±50.0 °C(Predicted)
• PSA: 75.99000
• Density: 1.370±0.06 g/cm3(Predicted)
• LogP: 2.46530
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 286.08412354
• Heavy Atom Count: 21
• Complexity: 377

Purity/Quality:

DihydrobiochaninA ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2COC3=CC(=CC(=C3C2=O)O)O

Technology Process of Dihydrobiochanin A

There total 9 articles about Dihydrobiochanin A which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

5,7-bisethoxymethoxy-4'-methoxyisoflavanone (104556-50-5) → Dihydrobiochanin A (83920-62-1)

Guidance literature:

With hydrogenchloride; In methanol; for 0.166667h;

Reference yield: 90.0%

5,7-Dihydroxy-3-(4-methoxy-phenyl)-chromen-4-on (491-80-5) → Dihydrobiochanin A (83920-62-1) + (3S,4R)-3-(4-Methoxy-phenyl)-chroman-4,5,7-triol

Guidance literature:

With ammonium formate; palladium on activated charcoal; In methanol; Ambient temperature;

Reference yield: 75.0%

5,7-Bis-methoxymethoxy-3-(4-methoxy-phenyl)-chroman-4-one (66152-06-5) → Dihydrobiochanin A (83920-62-1)

Guidance literature:

With hydrogenchloride; In methanol; for 0.166667h; Heating;

upstream raw materials:

5,7-Dihydroxy-3-(4-methoxy-phenyl)-chromen-4-on

5,7-bisethoxymethoxy-4'-methoxyisoflavanone

5,7-Bis-methoxymethoxy-3-(4-methoxy-phenyl)-chroman-4-one

2,4,6-trihydroxy-4'-methoxydeoxybenzoin

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