3',4',7-Tri(hydroxyethyl)quercetin
TL;DR: 3',4',7-Tri(hydroxyethyl)quercetin (CAS 23077-88-5) is a chemical compound with molecular formula C21H26O10 and molecular weight 438.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3,4-dihydroxy-3,4-bis(2-hydroxyethyl)cyclohexa-1,5-dien-1-yl]-3,5,7-trihydroxy-7-(2-hydroxyethyl)-8H-chromen-4-one
Also Known As: 3',4',7-Tri(hydroxyethyl)quercetin, Troxerutin Impurity 15, 1-Docosanol, dihydrogen phosphate, 2-[3,4-dihydroxy-3,4-bis(2-hydroxyethyl)cyclohexa-1,5-dien-1-yl]-3,5,7-trihydroxy-7-(2-hydroxyethyl)-8H-chromen-4-one, 2-[3,4-Dihydroxy-3,4-bis(2-hydroxyethyl)cyclohexa-1,5-dien-1-yl]-3,5,7-trihydroxy-7-(2-hydroxyethyl)-7,8-dihydro-4H-1-benzopyran-4-one
| Molecular Formula | C21H26O10 |
|---|---|
| Molecular Weight | 438.15 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.1526 |
| Heavy Atoms | 31 |
| Complexity | 926.0 |
Chemical Identifiers
| CAS Number | 23077-88-5 |
|---|---|
| SMILES | C1C2=C(C(=CC1(CCO)O)O)C(=O)C(=C(O2)C3=CC(C(C=C3)(CCO)O)(CCO)O)O |
| InChIKey | PZUMWZYYGVUFKC-UHFFFAOYSA-N |
Product Overview
3',4',7-Tri(hydroxyethyl)quercetin (CAS 23077-88-5), with molecular formula C21H26O10 and molecular weight 438.15 g/mol. IUPAC: 2-[3,4-dihydroxy-3,4-bis(2-hydroxyethyl)cyclohexa-1,5-dien-1-yl]-3,5,7-trihydroxy-7-(2-hydroxyethyl)-8H-chromen-4-one.
Chemical Property Profile of 3',4',7-Tri(hydroxyethyl)quercetin
Property Insights of 3',4',7-Tri(hydroxyethyl)quercetin
The XLogP value of -0.8 indicates that 3',4',7-Tri(hydroxyethyl)quercetin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting 3',4',7-Tri(hydroxyethyl)quercetin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3',4',7-Tri(hydroxyethyl)quercetin has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3',4',7-Tri(hydroxyethyl)quercetin?
The CAS number of 3',4',7-Tri(hydroxyethyl)quercetin is 23077-88-5.
What is the molecular formula of 3',4',7-Tri(hydroxyethyl)quercetin?
The molecular formula of 3',4',7-Tri(hydroxyethyl)quercetin is C21H26O10.
What is the molecular weight of 3',4',7-Tri(hydroxyethyl)quercetin?
The molecular weight of 3',4',7-Tri(hydroxyethyl)quercetin is 438.15 g/mol.
Where can I buy 3',4',7-Tri(hydroxyethyl)quercetin?
You can request a quote for 3',4',7-Tri(hydroxyethyl)quercetin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4',7-Tri(hydroxyethyl)quercetin?
Yes, KEHONG BIO provides custom synthesis services for 3',4',7-Tri(hydroxyethyl)quercetin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.