Ethyl 2-acetyloxypropanoate
TL;DR: Ethyl 2-acetyloxypropanoate (CAS 2985-28-6) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetyloxypropanoate
Also Known As: ethyl 2-acetyloxypropanoate, ethyl acetyl lactate, ethyl 2-acetoxypropanoate, ETHYL 2-(ACETYLOXY)PROPANOATE, 2-Acetoxypropanoic acid ethyl ester
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 2985-28-6 |
|---|---|
| SMILES | CCOC(=O)C(C)OC(=O)C |
| InChIKey | BCHOKJRLDTXCSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-acetyloxypropanoate (CAS 2985-28-6), with molecular formula C7H12O4 and molecular weight 160.07 g/mol. IUPAC: ethyl 2-acetyloxypropanoate.
Chemical Property Profile of Ethyl 2-acetyloxypropanoate
Property Insights of Ethyl 2-acetyloxypropanoate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-acetyloxypropanoate. With a topological polar surface area (TPSA) of 52.6 Ų, Ethyl 2-acetyloxypropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-acetyloxypropanoate 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-acetyloxypropanoate?
The CAS number of Ethyl 2-acetyloxypropanoate is 2985-28-6.
What is the molecular formula of Ethyl 2-acetyloxypropanoate?
The molecular formula of Ethyl 2-acetyloxypropanoate is C7H12O4.
What is the molecular weight of Ethyl 2-acetyloxypropanoate?
The molecular weight of Ethyl 2-acetyloxypropanoate is 160.07 g/mol.
Where can I buy Ethyl 2-acetyloxypropanoate?
You can request a quote for Ethyl 2-acetyloxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-acetyloxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-acetyloxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.