Quercetin-5'-sulfonic acid
TL;DR: Quercetin-5'-sulfonic acid (CAS 31273-65-1) is a chemical compound with molecular formula C15H10O10S and molecular weight 382.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)benzenesulfonic acid
Also Known As: quercetin-5'-sulfonic acid, Quercetine 5 -sulfonic acid, Quercetin-5 - sulfonic acid, Benzenesulfonic acid, 2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxo-4H-1-benzopyran-2-yl)-, J2.082.101I
| Molecular Formula | C15H10O10S |
|---|---|
| Molecular Weight | 382.00 g/mol |
| LogP | 1.2347 |
| Topological Polar Surface Area | 185.73 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 381.99948 |
| Heavy Atoms | 26 |
| Complexity | 1223.6313 |
Chemical Identifiers
| CAS Number | 31273-65-1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)S(=O)(=O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O |
Product Overview
Quercetin-5'-sulfonic acid (CAS 31273-65-1), with molecular formula C15H10O10S and molecular weight 382.00 g/mol. IUPAC: 2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)benzenesulfonic acid.
Chemical Property Profile of Quercetin-5'-sulfonic acid
Property Insights of Quercetin-5'-sulfonic acid
The XLogP value of 1.2347 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quercetin-5'-sulfonic acid. The TPSA of 185.73 Ų indicates high polarity, suggesting Quercetin-5'-sulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quercetin-5'-sulfonic acid has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quercetin-5'-sulfonic acid?
The CAS number of Quercetin-5'-sulfonic acid is 31273-65-1.
What is the molecular formula of Quercetin-5'-sulfonic acid?
The molecular formula of Quercetin-5'-sulfonic acid is C15H10O10S.
What is the molecular weight of Quercetin-5'-sulfonic acid?
The molecular weight of Quercetin-5'-sulfonic acid is 382.00 g/mol.
Where can I buy Quercetin-5'-sulfonic acid?
You can request a quote for Quercetin-5'-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quercetin-5'-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for Quercetin-5'-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.