1,3,8-Trihydroxy-5-methoxyxanthone
TL;DR: 1,3,8-Trihydroxy-5-methoxyxanthone (CAS 552-00-1) is a chemical compound with molecular formula C14H10O6 and molecular weight 274.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,8-trihydroxy-5-methoxyxanthen-9-one
Also Known As: Isobellidifolin, Xanthone der., 1,3,8-trihydroxy-5-methoxyxanthone, 1,3,8-trihydroxy-5-methoxyxanthen-9-one, 5-Methoxy-1,3,8-trihyroxyxanthen-9-one
| Molecular Formula | C14H10O6 |
|---|---|
| Molecular Weight | 274.05 g/mol |
| LogP | 2.0716 |
| Topological Polar Surface Area | 100.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.04773 |
| Heavy Atoms | 20 |
| Complexity | 893.67456 |
Chemical Identifiers
| CAS Number | 552-00-1 |
|---|---|
| SMILES | COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C(C=C3O2)O)O |
Product Overview
1,3,8-Trihydroxy-5-methoxyxanthone (CAS 552-00-1), with molecular formula C14H10O6 and molecular weight 274.05 g/mol. IUPAC: 1,3,8-trihydroxy-5-methoxyxanthen-9-one.
Chemical Property Profile of 1,3,8-Trihydroxy-5-methoxyxanthone
Property Insights of 1,3,8-Trihydroxy-5-methoxyxanthone
The XLogP value of 2.0716 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,8-Trihydroxy-5-methoxyxanthone. The TPSA of 100.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,8-Trihydroxy-5-methoxyxanthone. Following Lipinski's Rule of Five, 1,3,8-Trihydroxy-5-methoxyxanthone has 3 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 1,3,8-Trihydroxy-5-methoxyxanthone?
The CAS number of 1,3,8-Trihydroxy-5-methoxyxanthone is 552-00-1.
What is the molecular formula of 1,3,8-Trihydroxy-5-methoxyxanthone?
The molecular formula of 1,3,8-Trihydroxy-5-methoxyxanthone is C14H10O6.
What is the molecular weight of 1,3,8-Trihydroxy-5-methoxyxanthone?
The molecular weight of 1,3,8-Trihydroxy-5-methoxyxanthone is 274.05 g/mol.
Where can I buy 1,3,8-Trihydroxy-5-methoxyxanthone?
You can request a quote for 1,3,8-Trihydroxy-5-methoxyxanthone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,8-Trihydroxy-5-methoxyxanthone?
Yes, KEHONG BIO provides custom synthesis services for 1,3,8-Trihydroxy-5-methoxyxanthone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.