Quercetin 3,3',4'-trimethyl ether
TL;DR: Quercetin 3,3',4'-trimethyl ether (CAS 14549-84-9) is a chemical compound with molecular formula C18H16O7 and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-3-methoxychromen-4-one
Also Known As: 5,7-Dihydroxy-3,3',4'-trimethoxyflavone, Quercetin 3,3',4'-trimethyl ether, 5,3',4'-trimethoxy flavone, 1-(4-Phenylbutyl)-piperazine, 3,3',4'-trimethoxy quercetin
| Molecular Formula | C18H16O7 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 2.897 |
| Topological Polar Surface Area | 98.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.0896 |
| Heavy Atoms | 25 |
| Complexity | 1004.4577 |
Chemical Identifiers
| CAS Number | 14549-84-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC)OC |
Product Overview
Quercetin 3,3',4'-trimethyl ether (CAS 14549-84-9), with molecular formula C18H16O7 and molecular weight 344.09 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-3-methoxychromen-4-one.
Chemical Property Profile of Quercetin 3,3',4'-trimethyl ether
Property Insights of Quercetin 3,3',4'-trimethyl ether
The XLogP value of 2.897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quercetin 3,3',4'-trimethyl ether. The TPSA of 98.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Quercetin 3,3',4'-trimethyl ether. Following Lipinski's Rule of Five, Quercetin 3,3',4'-trimethyl ether has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quercetin 3,3',4'-trimethyl ether?
The CAS number of Quercetin 3,3',4'-trimethyl ether is 14549-84-9.
What is the molecular formula of Quercetin 3,3',4'-trimethyl ether?
The molecular formula of Quercetin 3,3',4'-trimethyl ether is C18H16O7.
What is the molecular weight of Quercetin 3,3',4'-trimethyl ether?
The molecular weight of Quercetin 3,3',4'-trimethyl ether is 344.09 g/mol.
Where can I buy Quercetin 3,3',4'-trimethyl ether?
You can request a quote for Quercetin 3,3',4'-trimethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quercetin 3,3',4'-trimethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Quercetin 3,3',4'-trimethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.