2-(2-Methyl-4-oxochromen-8-yl)acetic acid
TL;DR: 2-(2-Methyl-4-oxochromen-8-yl)acetic acid (CAS 87627-22-3) is a chemical compound with molecular formula C12H10O4 and molecular weight 218.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-4-oxochromen-8-yl)acetic acid
Also Known As: 2-(2-methyl-4-oxochromen-8-yl)acetic acid, (2-methylchromon-8-yl)acetic acid, (2-Methyl-4-oxo-4H-1-benzopyran-8-yl)acetic acid
| Molecular Formula | C12H10O4 |
|---|---|
| Molecular Weight | 218.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.0579 |
| Heavy Atoms | 16 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 87627-22-3 |
|---|---|
| SMILES | CC1=CC(=O)C2=CC=CC(=C2O1)CC(=O)O |
| InChIKey | CJPZVNVWVHMBRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Methyl-4-oxochromen-8-yl)acetic acid (CAS 87627-22-3), with molecular formula C12H10O4 and molecular weight 218.06 g/mol. IUPAC: 2-(2-methyl-4-oxochromen-8-yl)acetic acid.
Chemical Property Profile of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid
Property Insights of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methyl-4-oxochromen-8-yl)acetic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-4-oxochromen-8-yl)acetic acid. Following Lipinski's Rule of Five, 2-(2-Methyl-4-oxochromen-8-yl)acetic 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 2-(2-Methyl-4-oxochromen-8-yl)acetic acid?
The CAS number of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid is 87627-22-3.
What is the molecular formula of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid?
The molecular formula of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid is C12H10O4.
What is the molecular weight of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid?
The molecular weight of 2-(2-Methyl-4-oxochromen-8-yl)acetic acid is 218.06 g/mol.
Where can I buy 2-(2-Methyl-4-oxochromen-8-yl)acetic acid?
You can request a quote for 2-(2-Methyl-4-oxochromen-8-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methyl-4-oxochromen-8-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-4-oxochromen-8-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.