Ethyl 2-oxocyclopentanecarboxylate
TL;DR: Ethyl 2-oxocyclopentanecarboxylate (CAS 611-10-9) is a chemical compound with molecular formula C8H12O3 and molecular weight 156.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxocyclopentane-1-carboxylate
Also Known As: Ethyl 2-oxocyclopentanecarboxylate, 2-Carbethoxycyclopentanone, ethyl 2-oxocyclopentane-1-carboxylate, Ethyl cyclopentanone-2-carboxylate, zlchem 859
| Molecular Formula | C8H12O3 |
|---|---|
| Molecular Weight | 156.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.07864 |
| Heavy Atoms | 11 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 611-10-9 |
|---|---|
| SMILES | CCOC(=O)C1CCCC1=O |
| InChIKey | JHZPNBKZPAWCJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-oxocyclopentanecarboxylate (CAS 611-10-9), with molecular formula C8H12O3 and molecular weight 156.08 g/mol. IUPAC: ethyl 2-oxocyclopentane-1-carboxylate.
Chemical Property Profile of Ethyl 2-oxocyclopentanecarboxylate
Property Insights of Ethyl 2-oxocyclopentanecarboxylate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-oxocyclopentanecarboxylate. With a topological polar surface area (TPSA) of 43.4 Ų, Ethyl 2-oxocyclopentanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-oxocyclopentanecarboxylate has 0 hydrogen bond donor(s) and 3 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 Ethyl 2-oxocyclopentanecarboxylate?
The CAS number of Ethyl 2-oxocyclopentanecarboxylate is 611-10-9.
What is the molecular formula of Ethyl 2-oxocyclopentanecarboxylate?
The molecular formula of Ethyl 2-oxocyclopentanecarboxylate is C8H12O3.
What is the molecular weight of Ethyl 2-oxocyclopentanecarboxylate?
The molecular weight of Ethyl 2-oxocyclopentanecarboxylate is 156.08 g/mol.
Where can I buy Ethyl 2-oxocyclopentanecarboxylate?
You can request a quote for Ethyl 2-oxocyclopentanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-oxocyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-oxocyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.