Ethyl 2-(2-oxooxolan-3-yl)acetate
TL;DR: Ethyl 2-(2-oxooxolan-3-yl)acetate (CAS 154-85-8) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-oxooxolan-3-yl)acetate
Also Known As: Ethoxy-2-nicotinsaeureethylester, ethyl 2-(2-oxooxolan-3-yl)acetate, ethyl(2-oxotetrahydrofuran-3-yl)acetate, tetrahydro-2-oxo-3-furanacetic acid,ethyl ester
| Molecular Formula | C8H12O4 |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 172.07356 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 154-85-8 |
|---|---|
| SMILES | CCOC(=O)CC1CCOC1=O |
| InChIKey | BCVZFYMADRCUDJ-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(2-oxooxolan-3-yl)acetate (CAS 154-85-8), with molecular formula C8H12O4 and molecular weight 172.07 g/mol. IUPAC: ethyl 2-(2-oxooxolan-3-yl)acetate.
Chemical Property Profile of Ethyl 2-(2-oxooxolan-3-yl)acetate
Property Insights of Ethyl 2-(2-oxooxolan-3-yl)acetate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(2-oxooxolan-3-yl)acetate. With a topological polar surface area (TPSA) of 52.6 Ų, Ethyl 2-(2-oxooxolan-3-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(2-oxooxolan-3-yl)acetate has 0 hydrogen bond donor(s) and 4 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-(2-oxooxolan-3-yl)acetate?
The CAS number of Ethyl 2-(2-oxooxolan-3-yl)acetate is 154-85-8.
What is the molecular formula of Ethyl 2-(2-oxooxolan-3-yl)acetate?
The molecular formula of Ethyl 2-(2-oxooxolan-3-yl)acetate is C8H12O4.
What is the molecular weight of Ethyl 2-(2-oxooxolan-3-yl)acetate?
The molecular weight of Ethyl 2-(2-oxooxolan-3-yl)acetate is 172.07 g/mol.
Where can I buy Ethyl 2-(2-oxooxolan-3-yl)acetate?
You can request a quote for Ethyl 2-(2-oxooxolan-3-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(2-oxooxolan-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(2-oxooxolan-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.