1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one
TL;DR: 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one (CAS 2054-36-6) is a chemical compound with molecular formula C16H14O6 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-3,6,7-trimethoxyxanthen-9-one
Also Known As: Xanthone der., 1-Hydroxy-3,6,7-trimethoxy xanthone, 1-Hydroxy-3,6,7-trimethoxyxanthone, 1-hydroxy-3,6,7-trimethoxyxanthen-9-one, 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one
| Molecular Formula | C16H14O6 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 2.6776 |
| Topological Polar Surface Area | 78.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.07904 |
| Heavy Atoms | 22 |
| Complexity | 925.4466 |
Chemical Identifiers
| CAS Number | 2054-36-6 |
|---|---|
| SMILES | COC1=CC(=C2C(=C1)OC3=CC(=C(C=C3C2=O)OC)OC)O |
Product Overview
1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one (CAS 2054-36-6), with molecular formula C16H14O6 and molecular weight 302.08 g/mol. IUPAC: 1-hydroxy-3,6,7-trimethoxyxanthen-9-one.
Chemical Property Profile of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one
Property Insights of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one
The XLogP value of 2.6776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one. The TPSA of 78.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one. Following Lipinski's Rule of Five, 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one has 1 hydrogen bond donor(s) and 6 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 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one?
The CAS number of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one is 2054-36-6.
What is the molecular formula of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one?
The molecular formula of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one is C16H14O6.
What is the molecular weight of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one?
The molecular weight of 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one is 302.08 g/mol.
Where can I buy 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one?
You can request a quote for 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-3,6,7-trimethoxy-9H-xanthen-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.