1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione
TL;DR: 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione (CAS 5018-84-8) is a chemical compound with molecular formula C17H14O5 and molecular weight 298.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-6,8-dimethoxy-3-methylanthracene-9,10-dione
Also Known As: Questin 6-methyl ether, Emodin 6,8-dimethyl ether, Emodin,3-dimethyl ether, Emodin, 1,3-dimethyl ether, emodin-6,8-di-O-methyl ether
| Molecular Formula | C17H14O5 |
|---|---|
| Molecular Weight | 298.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.08414 |
| Heavy Atoms | 22 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 5018-84-8 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC)OC |
| InChIKey | QJKZQZYKOMVBQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione (CAS 5018-84-8), with molecular formula C17H14O5 and molecular weight 298.08 g/mol. IUPAC: 1-hydroxy-6,8-dimethoxy-3-methylanthracene-9,10-dione.
Chemical Property Profile of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione
Property Insights of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione
The XLogP value of 3.4 indicates that 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione. Following Lipinski's Rule of Five, 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione has 1 hydrogen bond donor(s) and 5 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-6,8-dimethoxy-3-methyl-9,10-anthracenedione?
The CAS number of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione is 5018-84-8.
What is the molecular formula of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione?
The molecular formula of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione is C17H14O5.
What is the molecular weight of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione?
The molecular weight of 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione is 298.08 g/mol.
Where can I buy 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione?
You can request a quote for 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-6,8-dimethoxy-3-methyl-9,10-anthracenedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.