Chrysophanol dimethyl ether
TL;DR: Chrysophanol dimethyl ether (CAS 91193-18-9) is a chemical compound with molecular formula C17H14O4 and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-dimethoxy-3-methylanthracene-9,10-dione
Also Known As: Chrysophanol dimethyl ether, 1,8-dimethoxy-3-methylanthracene-9,10-dione, chrysophanoldimethylether, 1,8-Dimethoxy-3-methylanthraquinone, 1,8-dimethoxy-3-methyl-9,10-anthraquinone
| Molecular Formula | C17H14O4 |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.0892 |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 91193-18-9 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)OC)C(=O)C3=C(C2=O)C=CC=C3OC |
| InChIKey | LODCICIWBUFMMY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chrysophanol dimethyl ether (CAS 91193-18-9), with molecular formula C17H14O4 and molecular weight 282.09 g/mol. IUPAC: 1,8-dimethoxy-3-methylanthracene-9,10-dione.
Chemical Property Profile of Chrysophanol dimethyl ether
Property Insights of Chrysophanol dimethyl ether
The XLogP value of 3.2 indicates that Chrysophanol dimethyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Chrysophanol dimethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chrysophanol dimethyl ether has 0 hydrogen bond donor(s) and 4 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 Chrysophanol dimethyl ether?
The CAS number of Chrysophanol dimethyl ether is 91193-18-9.
What is the molecular formula of Chrysophanol dimethyl ether?
The molecular formula of Chrysophanol dimethyl ether is C17H14O4.
What is the molecular weight of Chrysophanol dimethyl ether?
The molecular weight of Chrysophanol dimethyl ether is 282.09 g/mol.
Where can I buy Chrysophanol dimethyl ether?
You can request a quote for Chrysophanol dimethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chrysophanol dimethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Chrysophanol dimethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.