2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one
TL;DR: 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one (CAS 7622-61-9) 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-dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one
Also Known As: Quercetin trimethyl ether, 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one, J1.043.208A, 2-(3,4-dihydroxyphenyl)-3,5,7-trimethoxy-chromen-4-one, 3 ,4 -Dihydroxy-3,5,7-trimethoxyflavone
| Molecular Formula | C18H16O7 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.0896 |
| Heavy Atoms | 25 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 7622-61-9 |
|---|---|
| SMILES | COC1=CC2=C(C(=C1)OC)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)OC |
| InChIKey | JUIYFXAMKWGUJQ-UHFFFAOYSA-N |
Product Overview
2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one (CAS 7622-61-9), with molecular formula C18H16O7 and molecular weight 344.09 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one.
Chemical Property Profile of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one
Property Insights of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one. Following Lipinski's Rule of Five, 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one 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 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one?
The CAS number of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one is 7622-61-9.
What is the molecular formula of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one?
The molecular formula of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one is C18H16O7.
What is the molecular weight of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one?
The molecular weight of 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one is 344.09 g/mol.
Where can I buy 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one?
You can request a quote for 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dihydroxyphenyl)-3,5,7-trimethoxychromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.