[(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid
TL;DR: [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid (CAS 902012-68-4) is a chemical compound with molecular formula C15H9ClO6 and molecular weight 320.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-chloro-1-hydroxy-9-oxoxanthen-3-yl)oxyacetic acid
Also Known As: 2-(6-chloro-1-hydroxy-9-oxoxanthen-3-yl)oxyacetic acid, 2-(6-chloro-1-hydroxy-9-oxo-xanthen-3-yl)oxyacetic Acid, [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid, 2-((6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy)acetic acid
| Molecular Formula | C15H9ClO6 |
|---|---|
| Molecular Weight | 320.01 g/mol |
| LogP | 2.7686 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.00876 |
| Heavy Atoms | 22 |
| Complexity | 959.54724 |
Chemical Identifiers
| CAS Number | 902012-68-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)OC3=CC(=CC(=C3C2=O)O)OCC(=O)O |
Product Overview
[(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid (CAS 902012-68-4), with molecular formula C15H9ClO6 and molecular weight 320.01 g/mol. IUPAC: 2-(6-chloro-1-hydroxy-9-oxoxanthen-3-yl)oxyacetic acid.
Chemical Property Profile of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid
Property Insights of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid
The XLogP value of 2.7686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid. Following Lipinski's Rule of Five, [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid has 2 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-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid?
The CAS number of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid is 902012-68-4.
What is the molecular formula of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid?
The molecular formula of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid is C15H9ClO6.
What is the molecular weight of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid?
The molecular weight of [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid is 320.01 g/mol.
Where can I buy [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid?
You can request a quote for [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.