Chromone-3-carboxylic acid
TL;DR: Chromone-3-carboxylic acid (CAS 39079-62-4) is a chemical compound with molecular formula C10H6O4 and molecular weight 190.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxochromene-3-carboxylic acid
Also Known As: Chromone-3-carboxylic acid, 4-oxo-4H-chromene-3-carboxylic acid, 4-oxochromene-3-carboxylic acid, 3-carboxychromone, Maybridge1_005842
| Molecular Formula | C10H6O4 |
|---|---|
| Molecular Weight | 190.03 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.02661 |
| Heavy Atoms | 14 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 39079-62-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CO2)C(=O)O |
| InChIKey | PCIITXGDSHXTSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chromone-3-carboxylic acid (CAS 39079-62-4), with molecular formula C10H6O4 and molecular weight 190.03 g/mol. IUPAC: 4-oxochromene-3-carboxylic acid.
Chemical Property Profile of Chromone-3-carboxylic acid
Property Insights of Chromone-3-carboxylic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chromone-3-carboxylic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Chromone-3-carboxylic acid. Following Lipinski's Rule of Five, Chromone-3-carboxylic acid has 1 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 Chromone-3-carboxylic acid?
The CAS number of Chromone-3-carboxylic acid is 39079-62-4.
What is the molecular formula of Chromone-3-carboxylic acid?
The molecular formula of Chromone-3-carboxylic acid is C10H6O4.
What is the molecular weight of Chromone-3-carboxylic acid?
The molecular weight of Chromone-3-carboxylic acid is 190.03 g/mol.
Where can I buy Chromone-3-carboxylic acid?
You can request a quote for Chromone-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chromone-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Chromone-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.