Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate
TL;DR: Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate (CAS 141546-97-6) is a chemical compound with molecular formula C7H12F2O4 and molecular weight 198.07036 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate
Also Known As: Ethyl 3-Ethoxy-2,2-difluoro-3-hydroxypropionate, ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate, 3-Ethoxy-2,2-difluoro-3-hydroxypropionic Acid Ethyl Ester, Ethyl3-ethoxy-2,2-difluoro-3-hydroxypropionate, ethyl 3-ethoxy-2,2-difluoro-3-hydroxy-propanoate
Technical Specifications
| Molecular Formula | C7H12F2O4 |
| Molecular Weight | 198.07036 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 198.07036 Da |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
| SMILES | CCOC(C(C(=O)OCC)(F)F)O |
| InChIKey | DCDGEVPPIDIMON-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate
Property Insights of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate. With a topological polar surface area (TPSA) of 55.8 Ų, Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate?
The CAS number of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate is 141546-97-6.
What is the molecular formula of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate?
The molecular formula of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate is C7H12F2O4.
What is the molecular weight of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate?
The molecular weight of Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate is 198.07036 g/mol.
Where can I buy Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate?
You can request a quote for Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3-ethoxy-2,2-difluoro-3-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.