Apometzgerin

Base Information

Chemical Name:Apometzgerin
CAS No.:76900-87-3
Molecular Formula:C₁₇H₁₄O₇
Molecular Weight:330.294
Hs Code.:
DSSTox Substance ID:DTXSID10227701
Nikkaji Number:J3.233.457A
Wikidata:Q83107514
Metabolomics Workbench ID:23962
ChEMBL ID:CHEMBL3933594
Mol file:76900-87-3.mol

Synonyms:Apometzgerin;76900-87-3;5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)chromen-4-one;Tricetin 3',4'-dimethyl ether;4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-;4H-1-Benzopyran-4-one,5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-;CHEMBL3933594;DTXSID10227701;CHEBI:185408;LMPK12110879;5,7,3'-trihydroxy-4',5'-dimethoxyflavone

Suppliers and Price of Apometzgerin

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 3 raw suppliers

Chemical Property of Apometzgerin

Chemical Property:

Vapor Pressure:3.86E-15mmHg at 25°C
Boiling Point:603.1°C at 760 mmHg
Flash Point:225.8°C
PSA：109.36000
Density:1.483g/cm³
LogP:2.59400
XLogP3:1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:330.07395278
Heavy Atom Count:24
Complexity:505

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1OC)O)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

Technology Process of Apometzgerin

There total 2 articles about Apometzgerin 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: 14.3%

: 29865-90-5
3-hydroxy-4,5-dimethoxybenzaldehyde

: 110865-03-7
2-chloro-1-(2,4,6-trihydroxyphenyl)ethan-1-one

: 76900-87-3
5,7-dihydroxy-2-(3,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one

Guidance literature:: 3-hydroxy-4,5-dimethoxybenzaldehyde; 2-chloro-1-(2,4,6-trihydroxyphenyl)ethan-1-one; With potassium hydroxide; In ethanol; at 20 ℃; for 3h;

With hydrogenchloride; In ethanol; water; at 55 ℃; for 1h;
DOI:10.1016/j.bmc.2016.11.055

Reference yield:

: 108-73-6
3,5-dihydroxyphenol

: 76900-87-3
5,7-dihydroxy-2-(3,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one

Guidance literature:: Multi-step reaction with 3 steps

1.1: zinc(II) chloride / diethyl ether / 0 - 5 °C

1.2: 6 h / 0 - 5 °C

2.1: hydrogenchloride / water / 8 h / 20 °C

3.1: potassium hydroxide / ethanol / 3 h / 20 °C

3.2: 1 h / 55 °C

With hydrogenchloride; potassium hydroxide; zinc(II) chloride; In diethyl ether; ethanol; water;
DOI:10.1016/j.bmc.2016.11.055