7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One
TL;DR: 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One (CAS 1174277-32-7) is a chemical compound with molecular formula C15H16O9 and molecular weight 340.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
Also Known As: Esculin, Esculin hydrate, aesculin, Polychrom, Esculetol)
| Molecular Formula | C15H16O9 |
|---|---|
| Molecular Weight | 340.08 g/mol |
| LogP | -1.3227 |
| Topological Polar Surface Area | 149.82 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.07944 |
| Heavy Atoms | 24 |
| Complexity | 784.09863 |
Chemical Identifiers
| CAS Number | 1174277-32-7 |
|---|---|
| SMILES | C1=CC(=O)OC2=CC(=C(C=C21)OC3C(C(C(C(O3)CO)O)O)O)O |
Product Overview
7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One (CAS 1174277-32-7), with molecular formula C15H16O9 and molecular weight 340.08 g/mol. IUPAC: 7-hydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one.
Chemical Property Profile of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One
Property Insights of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One
The XLogP value of -1.3227 indicates that 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.82 Ų indicates high polarity, suggesting 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One?
The CAS number of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One is 1174277-32-7.
What is the molecular formula of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One?
The molecular formula of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One is C15H16O9.
What is the molecular weight of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One?
The molecular weight of 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One is 340.08 g/mol.
Where can I buy 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One?
You can request a quote for 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One?
Yes, KEHONG BIO provides custom synthesis services for 7-Hydroxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-2-One and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.