6,7-Dihydroxy-4-coumarinylacetic acid
TL;DR: 6,7-Dihydroxy-4-coumarinylacetic acid (CAS 88404-14-2) is a chemical compound with molecular formula C11H8O6 and molecular weight 236.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-dihydroxy-2-oxochromen-4-yl)acetic acid
Also Known As: 6,7-Dihydroxycoumarin-4-acetic Acid, 6,7-Dihydroxy-4-coumarinylacetic acid, 2-(6,7-dihydroxy-2-oxochromen-4-yl)acetic acid, 6,7-Dihydroxycoumarinyl-4-acetic, 6,7-DIHYDROXYCOUMARIN-4-ACETICACID
| Molecular Formula | C11H8O6 |
|---|---|
| Molecular Weight | 236.03 g/mol |
| LogP | 0.8313 |
| Topological Polar Surface Area | 107.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.03209 |
| Heavy Atoms | 17 |
| Complexity | 654.7946 |
Chemical Identifiers
| CAS Number | 88404-14-2 |
|---|---|
| SMILES | C1=C(C2=CC(=C(C=C2OC1=O)O)O)CC(=O)O |
Product Overview
6,7-Dihydroxy-4-coumarinylacetic acid (CAS 88404-14-2), with molecular formula C11H8O6 and molecular weight 236.03 g/mol. IUPAC: 2-(6,7-dihydroxy-2-oxochromen-4-yl)acetic acid.
Chemical Property Profile of 6,7-Dihydroxy-4-coumarinylacetic acid
Property Insights of 6,7-Dihydroxy-4-coumarinylacetic acid
The XLogP value of 0.8313 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dihydroxy-4-coumarinylacetic acid. The TPSA of 107.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dihydroxy-4-coumarinylacetic acid. Following Lipinski's Rule of Five, 6,7-Dihydroxy-4-coumarinylacetic acid has 3 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 6,7-Dihydroxy-4-coumarinylacetic acid?
The CAS number of 6,7-Dihydroxy-4-coumarinylacetic acid is 88404-14-2.
What is the molecular formula of 6,7-Dihydroxy-4-coumarinylacetic acid?
The molecular formula of 6,7-Dihydroxy-4-coumarinylacetic acid is C11H8O6.
What is the molecular weight of 6,7-Dihydroxy-4-coumarinylacetic acid?
The molecular weight of 6,7-Dihydroxy-4-coumarinylacetic acid is 236.03 g/mol.
Where can I buy 6,7-Dihydroxy-4-coumarinylacetic acid?
You can request a quote for 6,7-Dihydroxy-4-coumarinylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dihydroxy-4-coumarinylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dihydroxy-4-coumarinylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.