1-Oxophenalene-2-carboxylic acid
TL;DR: 1-Oxophenalene-2-carboxylic acid (CAS 7090-52-0) is a chemical compound with molecular formula C14H8O3 and molecular weight 224.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-oxophenalene-2-carboxylic acid
Also Known As: 1-oxophenalene-2-carboxylic acid, 1-Oxo-1H-phenalene-2-carboxylic acid, 1H-Phenalene-2-carboxylic acid, 1-oxo-, NCI60_007991
| Molecular Formula | C14H8O3 |
|---|---|
| Molecular Weight | 224.05 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.04735 |
| Heavy Atoms | 17 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 7090-52-0 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=C(C(=O)C3=CC=C2)C(=O)O |
| InChIKey | KOTMDYNKSPHVPA-UHFFFAOYSA-N |
Product Overview
1-Oxophenalene-2-carboxylic acid (CAS 7090-52-0), with molecular formula C14H8O3 and molecular weight 224.05 g/mol. IUPAC: 1-oxophenalene-2-carboxylic acid.
Chemical Property Profile of 1-Oxophenalene-2-carboxylic acid
Property Insights of 1-Oxophenalene-2-carboxylic acid
The XLogP value of 3.5 indicates that 1-Oxophenalene-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 1-Oxophenalene-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxophenalene-2-carboxylic acid has 1 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-Oxophenalene-2-carboxylic acid?
The CAS number of 1-Oxophenalene-2-carboxylic acid is 7090-52-0.
What is the molecular formula of 1-Oxophenalene-2-carboxylic acid?
The molecular formula of 1-Oxophenalene-2-carboxylic acid is C14H8O3.
What is the molecular weight of 1-Oxophenalene-2-carboxylic acid?
The molecular weight of 1-Oxophenalene-2-carboxylic acid is 224.05 g/mol.
Where can I buy 1-Oxophenalene-2-carboxylic acid?
You can request a quote for 1-Oxophenalene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxophenalene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxophenalene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.