4,8-Dioxo-2-adamantanecarboxylic acid
TL;DR: 4,8-Dioxo-2-adamantanecarboxylic acid (CAS 5202-69-7) is a chemical compound with molecular formula C11H12O4 and molecular weight 208.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dioxoadamantane-2-carboxylic acid
Also Known As: 4,8-Dioxo-2-adamantanecarboxylic acid, 4,8-dioxoadamantane-2-carboxylic acid, 2-Adamantanecarboxylic acid, 4,8-dioxo-, 4,8-Dioxo-2-adamantanecarboxylicacid, 4,8-Dioxo-2-adamantanecarboxylic acid #
| Molecular Formula | C11H12O4 |
|---|---|
| Molecular Weight | 208.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.07356 |
| Heavy Atoms | 15 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 5202-69-7 |
|---|---|
| SMILES | C1C2CC3C(C(C2=O)CC1C3=O)C(=O)O |
| InChIKey | BIWVQMXEISELNT-UHFFFAOYSA-N |
Product Overview
4,8-Dioxo-2-adamantanecarboxylic acid (CAS 5202-69-7), with molecular formula C11H12O4 and molecular weight 208.07 g/mol. IUPAC: 4,8-dioxoadamantane-2-carboxylic acid.
Chemical Property Profile of 4,8-Dioxo-2-adamantanecarboxylic acid
Property Insights of 4,8-Dioxo-2-adamantanecarboxylic acid
The XLogP value of -0.4 indicates that 4,8-Dioxo-2-adamantanecarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,8-Dioxo-2-adamantanecarboxylic acid. Following Lipinski's Rule of Five, 4,8-Dioxo-2-adamantanecarboxylic 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 4,8-Dioxo-2-adamantanecarboxylic acid?
The CAS number of 4,8-Dioxo-2-adamantanecarboxylic acid is 5202-69-7.
What is the molecular formula of 4,8-Dioxo-2-adamantanecarboxylic acid?
The molecular formula of 4,8-Dioxo-2-adamantanecarboxylic acid is C11H12O4.
What is the molecular weight of 4,8-Dioxo-2-adamantanecarboxylic acid?
The molecular weight of 4,8-Dioxo-2-adamantanecarboxylic acid is 208.07 g/mol.
Where can I buy 4,8-Dioxo-2-adamantanecarboxylic acid?
You can request a quote for 4,8-Dioxo-2-adamantanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,8-Dioxo-2-adamantanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,8-Dioxo-2-adamantanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.