1,8-二羟基蒽醌
TL;DR: 1,8-二羟基蒽醌 (CAS 117-10-2) is a chemical compound with molecular formula C14H8O4 and molecular weight 240.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-二羟基蒽醌
1,8-dihydroxyanthracene-9,10-dione
Also Known As: danthron, 1,8-Dihydroxyanthraquinone, Dantron, Chrysazin, Dorbane
| Molecular Formula | C14H8O4 |
|---|---|
| Molecular Weight | 240.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.04225 |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
| Melting Point | 192.8 °C |
| Boiling Point | Sublimes |
| Solubility | less than 1 mg/mL at 64 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 117-10-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O |
| InChIKey | QBPFLULOKWLNNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,8-二羟基蒽醌 (CAS 117-10-2), with molecular formula C14H8O4 and molecular weight 240.04 g/mol. IUPAC: 1,8-dihydroxyanthracene-9,10-dione.
Chemical Property Profile of 1,8-二羟基蒽醌
Property Insights of 1,8-二羟基蒽醌
The XLogP value of 3.2 indicates that 丹蒽醌 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8-二羟基蒽醌. Following Lipinski's Rule of Five, 丹蒽醌 has 2 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 丹蒽醌?
The CAS number of 丹蒽醌 is 117-10-2.
What is the molecular formula of 丹蒽醌?
The molecular formula of 丹蒽醌 is C14H8O4.
What is the molecular weight of 丹蒽醌?
The molecular weight of 丹蒽醌 is 240.04 g/mol.
Where can I buy 丹蒽醌?
You can request a quote for 丹蒽醌 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丹蒽醌?
Yes, KEHONG BIO provides custom synthesis services for 丹蒽醌 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.