3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid
TL;DR: 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid (CAS 15235-86-6) is a chemical compound with molecular formula C9H12O5 and molecular weight 200.06847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethyl-4-oxocyclopentane-1,2-dicarboxylic acid
Also Known As: 3-ethyl-4-oxocyclopentane-1,2-dicarboxylic acid, 1,2-Cyclopentanedicarboxylicacid, 3-ethyl-4-oxo-, 1,2-Cyclopentanedicarboxylicacid,3-ethyl-4-oxo
Technical Specifications
| Molecular Formula | C9H12O5 |
| Molecular Weight | 200.06847 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.06847 Da |
| Heavy Atoms | 14 |
| Complexity | 283.0 |
| SMILES | CCC1C(C(CC1=O)C(=O)O)C(=O)O |
| InChIKey | VDTUXLYZCFAPOC-UHFFFAOYSA-N |
Chemical Property Profile of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid
Property Insights of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid
The XLogP value of -0.3 indicates that 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid. Following Lipinski's Rule of Five, 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic 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
What is the CAS number of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid?
The CAS number of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid is 15235-86-6.
What is the molecular formula of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid?
The molecular formula of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid is C9H12O5.
What is the molecular weight of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid?
The molecular weight of 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid is 200.06847 g/mol.
Where can I buy 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid?
You can request a quote for 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 3-Ethyl-4-oxocyclopentane-1,2-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.