Quercetin pentaacetate
TL;DR: Quercetin pentaacetate (CAS 1064-06-8) is a chemical compound with molecular formula C25H20O12 and molecular weight 512.09546 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-acetyloxy-4-(3,5,7-triacetyloxy-4-oxochromen-2-yl)phenyl] acetate
Also Known As: Quercetin pentaacetate, Pentaacetylquercetin, Quercetin acetate, quercetin peracetate, QUERCETINPENTAACETATE
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C25H20O12 |
| Molecular Weight | 512.09546 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 158.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 512.09546 Da |
| Heavy Atoms | 37 |
| Complexity | 998.0 |
| SMILES | CC(=O)OC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | JQUHMSXLZZWRHU-UHFFFAOYSA-N |
Chemical Property Profile of Quercetin pentaacetate
Property Insights of Quercetin pentaacetate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quercetin pentaacetate. The TPSA of 158.0 Ų indicates high polarity, suggesting Quercetin pentaacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quercetin pentaacetate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Quercetin pentaacetate?
The CAS number of Quercetin pentaacetate is 1064-06-8.
What is the molecular formula of Quercetin pentaacetate?
The molecular formula of Quercetin pentaacetate is C25H20O12.
What is the molecular weight of Quercetin pentaacetate?
The molecular weight of Quercetin pentaacetate is 512.09546 g/mol.
Where can I buy Quercetin pentaacetate?
You can request a quote for Quercetin pentaacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Quercetin pentaacetate?
Yes, CoreyChem provides custom synthesis services for Quercetin pentaacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.