Barbigerone

Base Information

Chemical Name:Barbigerone
CAS No.:75425-27-3
Molecular Formula:C23H22O6
Molecular Weight:394.424
Hs Code.:
UNII:9BE3F2B4GD
DSSTox Substance ID:DTXSID30226352
Nikkaji Number:J939.589J
Wikipedia:Barbigerone
Wikidata:Q4859690
Metabolomics Workbench ID:22214
ChEMBL ID:CHEMBL3311038

Synonyms:barbigerone

Suppliers and Price of Barbigerone

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 14 raw suppliers

Chemical Property of Barbigerone

Chemical Property:

Vapor Pressure:3.36E-13mmHg at 25°C
Boiling Point:574.4°C at 760 mmHg
Flash Point:250.5°C
Density:1.229g/cm³
XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:394.14163842
Heavy Atom Count:29
Complexity:683

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1(C=CC2=C(O1)C=CC3=C2OC=C(C3=O)C4=CC(=C(C=C4OC)OC)OC)C

Technology Process of Barbigerone

There total 9 articles about Barbigerone 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:

: C₂₅H₃₀O₈

: 75425-27-3
2',4',5'-trimethoxy-6'',6''-dimethylpyrano(2'',3'':7,8)isoflavone

Guidance literature:: With hydrogenchloride; In methanol; water; for 6h; Reflux;
DOI:10.1016/j.fitote.2014.06.002

Reference yield:

: 4460-86-0,14374-62-0
asaraldehyde

: 75425-27-3
2',4',5'-trimethoxy-6'',6''-dimethylpyrano(2'',3'':7,8)isoflavone

Guidance literature:: Multi-step reaction with 6 steps

1: 80percent aq. KOH / ethanol / 24 h

3: 30percent H₂O₂, 5percent aq. NaOH / methanol; acetone / Ambient temperature

4: BF₃ etherate / benzene / 3 h / Ambient temperature

5: conc. HCl / acetic acid / 2 h / boiling water bath

6: K₂CO₃, KI / dioxane / 20 h / Heating

With hydrogenchloride; potassium hydroxide; sodium hydroxide; boron trifluoride diethyl etherate; dihydrogen peroxide; potassium carbonate; potassium iodide; In 1,4-dioxane; methanol; ethanol; acetic acid; acetone; benzene;

Reference yield:

: 91735-51-2
4'-Benzyloxy-2'-hydroxy-2,4,5-trimethoxychalcone

: 75425-27-3
2',4',5'-trimethoxy-6'',6''-dimethylpyrano(2'',3'':7,8)isoflavone

Guidance literature:: Multi-step reaction with 5 steps

2: 30percent H₂O₂, 5percent aq. NaOH / methanol; acetone / Ambient temperature

3: BF₃ etherate / benzene / 3 h / Ambient temperature

4: conc. HCl / acetic acid / 2 h / boiling water bath

5: K₂CO₃, KI / dioxane / 20 h / Heating

With hydrogenchloride; sodium hydroxide; boron trifluoride diethyl etherate; dihydrogen peroxide; potassium carbonate; potassium iodide; In 1,4-dioxane; methanol; acetic acid; acetone; benzene;