3-Methylflavone-8-carboxylic acid
TL;DR: 3-Methylflavone-8-carboxylic acid (CAS 3468-01-7) is a chemical compound with molecular formula C17H12O4 and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-oxo-2-phenylchromene-8-carboxylic acid
Also Known As: 3-Methylflavone-8-carboxylic acid, 8-Carboxy-3-methylflavone, 3-Methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylic acid, MFCA, Flavoxate impurity A CRS
| Molecular Formula | C17H12O4 |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.07355 |
| Heavy Atoms | 21 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 3468-01-7 |
|---|---|
| SMILES | CC1=C(OC2=C(C1=O)C=CC=C2C(=O)O)C3=CC=CC=C3 |
| InChIKey | KMMBBZOSQNLLMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylflavone-8-carboxylic acid (CAS 3468-01-7), with molecular formula C17H12O4 and molecular weight 280.07 g/mol. IUPAC: 3-methyl-4-oxo-2-phenylchromene-8-carboxylic acid.
Chemical Property Profile of 3-Methylflavone-8-carboxylic acid
Property Insights of 3-Methylflavone-8-carboxylic acid
The XLogP value of 3.4 indicates that 3-Methylflavone-8-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methylflavone-8-carboxylic acid. Following Lipinski's Rule of Five, 3-Methylflavone-8-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 3-Methylflavone-8-carboxylic acid?
The CAS number of 3-Methylflavone-8-carboxylic acid is 3468-01-7.
What is the molecular formula of 3-Methylflavone-8-carboxylic acid?
The molecular formula of 3-Methylflavone-8-carboxylic acid is C17H12O4.
What is the molecular weight of 3-Methylflavone-8-carboxylic acid?
The molecular weight of 3-Methylflavone-8-carboxylic acid is 280.07 g/mol.
Where can I buy 3-Methylflavone-8-carboxylic acid?
You can request a quote for 3-Methylflavone-8-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylflavone-8-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylflavone-8-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.