Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate
TL;DR: Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate (CAS 41301-66-0) is a chemical compound with molecular formula C12H18O5 and molecular weight 242.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentane-1-carboxylate
Also Known As: ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate, 2-Carbethoxy-2-(carbethoxymethyl)-1-cyclopentanone, ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentane-1-carboxylate, J3.394.112I, ethyl 1-ethoxycarbonyl-2-oxocyclopent-1-ylacetate
| Molecular Formula | C12H18O5 |
|---|---|
| Molecular Weight | 242.12 g/mol |
| LogP | 1.2421 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.11542 |
| Heavy Atoms | 17 |
| Complexity | 322.85767 |
Chemical Identifiers
| CAS Number | 41301-66-0 |
|---|---|
| SMILES | CCOC(=O)CC1(CCCC1=O)C(=O)OCC |
Product Overview
Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate (CAS 41301-66-0), with molecular formula C12H18O5 and molecular weight 242.12 g/mol. IUPAC: ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentane-1-carboxylate.
Chemical Property Profile of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate
Property Insights of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate
The XLogP value of 1.2421 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate. Following Lipinski's Rule of Five, Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate 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 Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate?
The CAS number of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate is 41301-66-0.
What is the molecular formula of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate?
The molecular formula of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate is C12H18O5.
What is the molecular weight of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate?
The molecular weight of Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate is 242.12 g/mol.
Where can I buy Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate?
You can request a quote for Ethyl 1-(2-ethoxy-2-oxoethyl)-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 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(2-ethoxy-2-oxoethyl)-2-oxocyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.