4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester
TL;DR: 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester (CAS 156293-34-4) is a chemical compound with molecular formula C11H16O5 and molecular weight 228.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-oxocyclopentane-1,2-dicarboxylate
Also Known As: diethyl 4-oxocyclopentane-1,2-dicarboxylate, 4-acetoxy-cyclohexanone, 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester, Diethyl 4-oxo-1,2-cyclopentanedicarboxylate, cis-4-Oxo-1,2-cyclopentanedicarboxylic acid diethyl ester
| Molecular Formula | C11H16O5 |
|---|---|
| Molecular Weight | 228.10 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 228.09978 |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 156293-34-4 |
|---|---|
| SMILES | CCOC(=O)C1CC(=O)CC1C(=O)OCC |
| InChIKey | GRPKMLGYFVVOJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester (CAS 156293-34-4), with molecular formula C11H16O5 and molecular weight 228.10 g/mol. IUPAC: diethyl 4-oxocyclopentane-1,2-dicarboxylate.
Chemical Property Profile of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester
Property Insights of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester. Following Lipinski's Rule of Five, 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester has 0 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 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester?
The CAS number of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester is 156293-34-4.
What is the molecular formula of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester?
The molecular formula of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester is C11H16O5.
What is the molecular weight of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester?
The molecular weight of 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester is 228.10 g/mol.
Where can I buy 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester?
You can request a quote for 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-cyclopentane-1,2-dicarboxylic acid diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.