6-Isopropoxy-9-oxoxanthene-2-carboxylic acid
TL;DR: 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid (CAS 33458-93-4) is a chemical compound with molecular formula C17H14O5 and molecular weight 298.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-oxo-6-propan-2-yloxyxanthene-2-carboxylic acid
Also Known As: 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid, 6-isopropoxy-9-oxo-9h-xanthene-2-carboxylic acid, 9-oxo-6-propan-2-yloxyxanthene-2-carboxylic acid, 6-Isopropoxy-9-xanthone-2-carboxylic acid, 6-(1-Methylethoxy)-9-oxo-9H-xanthene-2-carboxylic acid
| Molecular Formula | C17H14O5 |
|---|---|
| Molecular Weight | 298.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.08414 |
| Heavy Atoms | 22 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 33458-93-4 |
|---|---|
| SMILES | CC(C)OC1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O |
| InChIKey | AQFFXPQJLZFABJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Isopropoxy-9-oxoxanthene-2-carboxylic acid (CAS 33458-93-4), with molecular formula C17H14O5 and molecular weight 298.08 g/mol. IUPAC: 9-oxo-6-propan-2-yloxyxanthene-2-carboxylic acid.
Chemical Property Profile of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid
Property Insights of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid
The XLogP value of 3.9 indicates that 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid. Following Lipinski's Rule of Five, 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid has 1 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-Isopropoxy-9-oxoxanthene-2-carboxylic acid?
The CAS number of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid is 33458-93-4.
What is the molecular formula of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid?
The molecular formula of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid is C17H14O5.
What is the molecular weight of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid?
The molecular weight of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid is 298.08 g/mol.
Where can I buy 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid?
You can request a quote for 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.