丹米坎他醛
TL;DR: 丹米坎他醛 (CAS 477-84-9) is a chemical compound with molecular formula C16H10O5 and molecular weight 282.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丹米坎他醛
3-hydroxy-1-methoxy-9,10-dioxoanthracene-2-carbaldehyde
Also Known As: damnacanthal, Damnacantal, BiomolKI2_000030, 3-Hydroxy-1-methoxyanthraquinone-2-aldehyde, BMK1-C10
| Molecular Formula | C16H10O5 |
|---|---|
| Molecular Weight | 282.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.05283 |
| Heavy Atoms | 21 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 477-84-9 |
|---|---|
| SMILES | COC1=C2C(=CC(=C1C=O)O)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | IPDMWUNUULAXLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丹米坎他醛 (CAS 477-84-9), with molecular formula C16H10O5 and molecular weight 282.05 g/mol. IUPAC: 3-hydroxy-1-methoxy-9,10-dioxoanthracene-2-carbaldehyde.
Chemical Property Profile of 丹米坎他醛
Property Insights of 丹米坎他醛
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丹米坎他醛. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 丹米坎他醛. Following Lipinski's Rule of Five, 虎刺醛 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 虎刺醛?
The CAS number of 虎刺醛 is 477-84-9.
What is the molecular formula of 虎刺醛?
The molecular formula of 虎刺醛 is C16H10O5.
What is the molecular weight of 虎刺醛?
The molecular weight of 虎刺醛 is 282.05 g/mol.
Where can I buy 虎刺醛?
You can request a quote for 虎刺醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 虎刺醛?
Yes, KEHONG BIO provides custom synthesis services for 虎刺醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.