4-Oxophenalene-1,9-dicarboxylate
TL;DR: 4-Oxophenalene-1,9-dicarboxylate (CAS 6169-92-2) is a chemical compound with molecular formula C15H6O5-2 and molecular weight 266.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxophenalene-1,9-dicarboxylate
Also Known As: 4-oxophenalene-1,9-dicarboxylate, 1-Oxo-1H-phenalene-6,7-dicarboxylate
| Molecular Formula | C15H6O5-2 |
|---|---|
| Molecular Weight | 266.02 g/mol |
| LogP | -0.2237 |
| Topological Polar Surface Area | 97.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.0215 |
| Heavy Atoms | 20 |
| Complexity | 809.513 |
Chemical Identifiers
| CAS Number | 6169-92-2 |
|---|---|
| SMILES | C1=CC(=C2C(=CC=C3C2=C1C=CC3=O)C(=O)[O-])C(=O)[O-] |
Product Overview
4-Oxophenalene-1,9-dicarboxylate (CAS 6169-92-2), with molecular formula C15H6O5-2 and molecular weight 266.02 g/mol. IUPAC: 4-oxophenalene-1,9-dicarboxylate.
Chemical Property Profile of 4-Oxophenalene-1,9-dicarboxylate
Property Insights of 4-Oxophenalene-1,9-dicarboxylate
The XLogP value of -0.2237 indicates that 4-Oxophenalene-1,9-dicarboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxophenalene-1,9-dicarboxylate. Following Lipinski's Rule of Five, 4-Oxophenalene-1,9-dicarboxylate has 0 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 4-Oxophenalene-1,9-dicarboxylate?
The CAS number of 4-Oxophenalene-1,9-dicarboxylate is 6169-92-2.
What is the molecular formula of 4-Oxophenalene-1,9-dicarboxylate?
The molecular formula of 4-Oxophenalene-1,9-dicarboxylate is C15H6O5-2.
What is the molecular weight of 4-Oxophenalene-1,9-dicarboxylate?
The molecular weight of 4-Oxophenalene-1,9-dicarboxylate is 266.02 g/mol.
Where can I buy 4-Oxophenalene-1,9-dicarboxylate?
You can request a quote for 4-Oxophenalene-1,9-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxophenalene-1,9-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxophenalene-1,9-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.