6,8-Dimorpholinomethylquercetin dihydrochloride
TL;DR: 6,8-Dimorpholinomethylquercetin dihydrochloride (CAS 31123-95-2) is a chemical compound with molecular formula C25H30Cl2N2O9 and molecular weight 572.13 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-trihydroxy-6,8-bis(morpholin-4-ium-4-ylmethyl)chromen-4-one dichloride
Also Known As: 6,8-Dimorpholinomethylquercetin, dihydrochloride, 6,8-Dimorpholinomethylquercetin dihydrochloride, 6,8-Dimorpholinomethyl-3,3',4',5,7-pentahydroxyflavone, dihydrochloride, FLAVONE, 6,8-DIMORPHOLINOMETHYL-3,3',4',5,7-PENTAHYDROXY-, DIHYDROCHLORIDE, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(morpholin-4-ium-4-ylmethyl)chromen-4-one dichloride
| Molecular Formula | C25H30Cl2N2O9 |
|---|---|
| Molecular Weight | 572.13 g/mol |
| LogP | -7.17 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 572.1328 |
| Heavy Atoms | 38 |
| Complexity | 813.0 |
Chemical Identifiers
| CAS Number | 31123-95-2 |
|---|---|
| SMILES | C1COCC[NH+]1CC2=C(C(=C3C(=C2O)C(=O)C(=C(O3)C4=CC(=C(C=C4)O)O)O)C[NH+]5CCOCC5)O.[Cl-].[Cl-] |
| InChIKey | YXQFOIMOGDBJJK-UHFFFAOYSA-N |
Product Overview
6,8-Dimorpholinomethylquercetin dihydrochloride (CAS 31123-95-2), with molecular formula C25H30Cl2N2O9 and molecular weight 572.13 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(morpholin-4-ium-4-ylmethyl)chromen-4-one dichloride.
Chemical Property Profile of 6,8-Dimorpholinomethylquercetin dihydrochloride
Property Insights of 6,8-Dimorpholinomethylquercetin dihydrochloride
The XLogP value of -7.17 indicates that 6,8-Dimorpholinomethylquercetin dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting 6,8-Dimorpholinomethylquercetin dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6,8-Dimorpholinomethylquercetin dihydrochloride has 7 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 6,8-Dimorpholinomethylquercetin dihydrochloride?
The CAS number of 6,8-Dimorpholinomethylquercetin dihydrochloride is 31123-95-2.
What is the molecular formula of 6,8-Dimorpholinomethylquercetin dihydrochloride?
The molecular formula of 6,8-Dimorpholinomethylquercetin dihydrochloride is C25H30Cl2N2O9.
What is the molecular weight of 6,8-Dimorpholinomethylquercetin dihydrochloride?
The molecular weight of 6,8-Dimorpholinomethylquercetin dihydrochloride is 572.13 g/mol.
Where can I buy 6,8-Dimorpholinomethylquercetin dihydrochloride?
You can request a quote for 6,8-Dimorpholinomethylquercetin dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-Dimorpholinomethylquercetin dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 6,8-Dimorpholinomethylquercetin dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.