3-O-methylellagic acid

Base Information

Chemical Name:3-O-methylellagic acid
CAS No.:51768-38-8
Molecular Formula:C15H8O8
Molecular Weight:316.224
Hs Code.:
European Community (EC) Number:683-222-6
ChEMBL ID:CHEMBL564351
Metabolomics Workbench ID:142949
Nikkaji Number:J710.347F
Wikidata:Q104401532
Mol file:51768-38-8.mol

Synonyms:3-O-methylellagic acid;3-Methyl ellagic acid;51768-38-8;6,7,13-trihydroxy-14-methoxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione;3-O-methyllagic acid;trihydroxy(methoxy)[?]dione;CHEMBL564351;SCHEMBL2355138;C15H8O8;HY-N7430;AKOS040734809;FS-6832;CS-0128296

Suppliers and Price of 3-O-methylellagic acid

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

Sigma-Aldrich
3-Methyl ellagic acid phyproof? Reference Substance
10 mg
$ 388.00

Sigma-Aldrich
3-O-Methylellagic acid analytical standard
10mg
$ 728.00

ChemScene
3-O-Methylellagic acid
5mg
$ 980.00

Arctom
3-Methyl ellagic acid
5mg
$ 398.00

Total 8 raw suppliers

Chemical Property of 3-O-methylellagic acid

Chemical Property:

Boiling Point:734.3±60.0 °C(Predicted)
PKA:5.49±0.20(Predicted)
PSA：130.34000
Density:1.840±0.06 g/cm3(Predicted)
LogP:1.61580
XLogP3:1.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:1
Exact Mass:316.02191721
Heavy Atom Count:23
Complexity:536

Purity/Quality:

99%, ^*data from raw suppliers

3-Methyl ellagic acid phyproof? Reference Substance ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C2C3=C1OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O)O

Technology Process of 3-O-methylellagic acid

There total 2 articles about 3-O-methylellagic acid 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: 85.0%