Quercetin 3,3',4',7-tetraacetate
TL;DR: Quercetin 3,3',4',7-tetraacetate (CAS 7251-37-8) is a chemical compound with molecular formula C23H18O11 and molecular weight 470.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-4-(3,7-diacetyloxy-5-hydroxy-4-oxochromen-2-yl)phenyl] acetate
Also Known As: Quercetin 3,3',4',7-tetraacetate, 3,7,3 ,4 -Tetraacetylquercetin, QUERCETIN, 3,3',4',7-TETRAACETATE, 2-(Acetyloxy)-4-(3,7-bis(acetyloxy)-5-hydroxy-4-oxo-4H-chromen-2-yl)phenyl acetate, 3,3 ,4 ,7-Tetra-O-acetylquercetin
| Molecular Formula | C23H18O11 |
|---|---|
| Molecular Weight | 470.08 g/mol |
| LogP | 2.8668 |
| Topological Polar Surface Area | 155.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.0849 |
| Heavy Atoms | 34 |
| Complexity | 1398.2722 |
Chemical Identifiers
| CAS Number | 7251-37-8 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)C)O)OC(=O)C)OC(=O)C |
Product Overview
Quercetin 3,3',4',7-tetraacetate (CAS 7251-37-8), with molecular formula C23H18O11 and molecular weight 470.08 g/mol. IUPAC: [2-acetyloxy-4-(3,7-diacetyloxy-5-hydroxy-4-oxochromen-2-yl)phenyl] acetate.
Chemical Property Profile of Quercetin 3,3',4',7-tetraacetate
Property Insights of Quercetin 3,3',4',7-tetraacetate
The XLogP value of 2.8668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quercetin 3,3',4',7-tetraacetate. The TPSA of 155.64 Ų indicates high polarity, suggesting Quercetin 3,3',4',7-tetraacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quercetin 3,3',4',7-tetraacetate has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quercetin 3,3',4',7-tetraacetate?
The CAS number of Quercetin 3,3',4',7-tetraacetate is 7251-37-8.
What is the molecular formula of Quercetin 3,3',4',7-tetraacetate?
The molecular formula of Quercetin 3,3',4',7-tetraacetate is C23H18O11.
What is the molecular weight of Quercetin 3,3',4',7-tetraacetate?
The molecular weight of Quercetin 3,3',4',7-tetraacetate is 470.08 g/mol.
Where can I buy Quercetin 3,3',4',7-tetraacetate?
You can request a quote for Quercetin 3,3',4',7-tetraacetate 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',7-tetraacetate?
Yes, KEHONG BIO provides custom synthesis services for Quercetin 3,3',4',7-tetraacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.