1,8,9-Triacetoxyanthracene
TL;DR: 1,8,9-Triacetoxyanthracene (CAS 16203-97-7) is a chemical compound with molecular formula C20H16O6 and molecular weight 352.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8,9-diacetyloxyanthracen-1-yl) acetate
Also Known As: Exolan, Triacetyldithranol, Anthralin triacetate, Dithranol triacetate, 1,8,9-Triacetoxyanthracene
| Molecular Formula | C20H16O6 |
|---|---|
| Molecular Weight | 352.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 352.0947 |
| Heavy Atoms | 26 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 16203-97-7 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC2=CC3=C(C(=CC=C3)OC(=O)C)C(=C21)OC(=O)C |
| InChIKey | IPWOSICBVUXMML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,8,9-Triacetoxyanthracene (CAS 16203-97-7), with molecular formula C20H16O6 and molecular weight 352.09 g/mol. IUPAC: (8,9-diacetyloxyanthracen-1-yl) acetate.
Chemical Property Profile of 1,8,9-Triacetoxyanthracene
Property Insights of 1,8,9-Triacetoxyanthracene
The XLogP value of 3.7 indicates that 1,8,9-Triacetoxyanthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8,9-Triacetoxyanthracene. Following Lipinski's Rule of Five, 1,8,9-Triacetoxyanthracene has 0 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 1,8,9-Triacetoxyanthracene?
The CAS number of 1,8,9-Triacetoxyanthracene is 16203-97-7.
What is the molecular formula of 1,8,9-Triacetoxyanthracene?
The molecular formula of 1,8,9-Triacetoxyanthracene is C20H16O6.
What is the molecular weight of 1,8,9-Triacetoxyanthracene?
The molecular weight of 1,8,9-Triacetoxyanthracene is 352.09 g/mol.
Where can I buy 1,8,9-Triacetoxyanthracene?
You can request a quote for 1,8,9-Triacetoxyanthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8,9-Triacetoxyanthracene?
Yes, KEHONG BIO provides custom synthesis services for 1,8,9-Triacetoxyanthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.