Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid
TL;DR: Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid (CAS 95372-57-9) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[5.3.0.02,6]decane-4,9-dicarboxylic acid
Also Known As: PERHYDROCYCLOBUTA(1,2:3,4)DICYCLOPENTENE-2,5-DICARBOXYLIC ACID, 661-562-6, RefChem:860309
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 1.454 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 288.92792 |
Chemical Identifiers
| CAS Number | 95372-57-9 |
|---|---|
| SMILES | C1C(CC2C1C3C2CC(C3)C(=O)O)C(=O)O |
Product Overview
Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid (CAS 95372-57-9), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: tricyclo[5.3.0.02,6]decane-4,9-dicarboxylic acid.
Chemical Property Profile of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid
Property Insights of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid
The XLogP value of 1.454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid. Following Lipinski's Rule of Five, Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid has 2 hydrogen bond donor(s) and 2 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 Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid?
The CAS number of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid is 95372-57-9.
What is the molecular formula of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid?
The molecular formula of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid is C12H16O4.
What is the molecular weight of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid?
The molecular weight of Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid is 224.10 g/mol.
Where can I buy Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid?
You can request a quote for Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Perhydrocyclobuta(1,2:3,4)dicyclopentene-2,5-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.