1,8,9-Anthracenetriol
TL;DR: 1,8,9-Anthracenetriol (CAS 480-22-8) is a chemical compound with molecular formula C14H10O3 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
anthracene-1,8,9-triol
Also Known As: 1,8,9-Trihydroxyanthracene, anthralin, anthracene-1,8,9-triol, Dithranol, 1,8,9-ANTHRACENETRIOL
| Molecular Formula | C14H10O3 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.06299 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
| Melting Point | 349 to 181.1 °C |
| Solubility | less than 1 mg/mL at 63 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 480-22-8 |
|---|---|
| SMILES | C1=CC2=CC3=C(C(=CC=C3)O)C(=C2C(=C1)O)O |
| InChIKey | YUTJCNNFTOIOGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,8,9-Anthracenetriol (CAS 480-22-8), with molecular formula C14H10O3 and molecular weight 226.06 g/mol. IUPAC: anthracene-1,8,9-triol.
Chemical Property Profile of 1,8,9-Anthracenetriol
Property Insights of 1,8,9-Anthracenetriol
The XLogP value of 3.9 indicates that 1,8,9-Anthracenetriol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8,9-Anthracenetriol. Following Lipinski's Rule of Five, 1,8,9-Anthracenetriol has 3 hydrogen bond donor(s) and 3 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-Anthracenetriol?
The CAS number of 1,8,9-Anthracenetriol is 480-22-8.
What is the molecular formula of 1,8,9-Anthracenetriol?
The molecular formula of 1,8,9-Anthracenetriol is C14H10O3.
What is the molecular weight of 1,8,9-Anthracenetriol?
The molecular weight of 1,8,9-Anthracenetriol is 226.06 g/mol.
Where can I buy 1,8,9-Anthracenetriol?
You can request a quote for 1,8,9-Anthracenetriol 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-Anthracenetriol?
Yes, KEHONG BIO provides custom synthesis services for 1,8,9-Anthracenetriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.