4,8-Dioxo-1,3-adamantanedicarboxylic acid
TL;DR: 4,8-Dioxo-1,3-adamantanedicarboxylic acid (CAS 41585-35-7) is a chemical compound with molecular formula C12H12O6 and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dioxoadamantane-1,3-dicarboxylic acid
Also Known As: 4,8-dioxoadamantane-1,3-dicarboxylic Acid, adamantane-2,6-dione-1,5-dicarboxylic, adamantane-2,6-dione-1,5-dicarboxylic acid, 4,8-dioxo-1,3-adamantanedicarboxylic acid
| Molecular Formula | C12H12O6 |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 0.1002 |
| Topological Polar Surface Area | 108.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.06339 |
| Heavy Atoms | 18 |
| Complexity | 464.69702 |
Chemical Identifiers
| CAS Number | 41585-35-7 |
|---|---|
| SMILES | C1C2CC3(CC(C2=O)(CC1C3=O)C(=O)O)C(=O)O |
Product Overview
4,8-Dioxo-1,3-adamantanedicarboxylic acid (CAS 41585-35-7), with molecular formula C12H12O6 and molecular weight 252.06 g/mol. IUPAC: 4,8-dioxoadamantane-1,3-dicarboxylic acid.
Chemical Property Profile of 4,8-Dioxo-1,3-adamantanedicarboxylic acid
Property Insights of 4,8-Dioxo-1,3-adamantanedicarboxylic acid
The XLogP value of 0.1002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,8-Dioxo-1,3-adamantanedicarboxylic acid. The TPSA of 108.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,8-Dioxo-1,3-adamantanedicarboxylic acid. Following Lipinski's Rule of Five, 4,8-Dioxo-1,3-adamantanedicarboxylic acid has 2 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-1,3-adamantanedicarboxylic acid?
The CAS number of 4,8-Dioxo-1,3-adamantanedicarboxylic acid is 41585-35-7.
What is the molecular formula of 4,8-Dioxo-1,3-adamantanedicarboxylic acid?
The molecular formula of 4,8-Dioxo-1,3-adamantanedicarboxylic acid is C12H12O6.
What is the molecular weight of 4,8-Dioxo-1,3-adamantanedicarboxylic acid?
The molecular weight of 4,8-Dioxo-1,3-adamantanedicarboxylic acid is 252.06 g/mol.
Where can I buy 4,8-Dioxo-1,3-adamantanedicarboxylic acid?
You can request a quote for 4,8-Dioxo-1,3-adamantanedicarboxylic 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-1,3-adamantanedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,8-Dioxo-1,3-adamantanedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.