2-Chloroethyl 4-fluoro-2-hydroxybutanoate
TL;DR: 2-Chloroethyl 4-fluoro-2-hydroxybutanoate (CAS 63905-00-0) is a chemical compound with molecular formula C6H10ClFO3 and molecular weight 184.03024 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloroethyl 4-fluoro-2-hydroxybutanoate
Also Known As: TL 1492, 2-chloroethyl 4-fluoro-2-hydroxybutanoate, 2-Chloroethyl gamma-fluoro-beta-hydroxybutyrate, beta-Chloroethyl gamma-fluoro-beta-hydroxybutyrate, 4-Fluoro-2-hydroxybutyric acid 2-chloroethyl ester
Technical Specifications
| Molecular Formula | C6H10ClFO3 |
| Molecular Weight | 184.03024 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 184.03024 Da |
| Heavy Atoms | 11 |
| Complexity | 120.0 |
| SMILES | C(CF)C(C(=O)OCCCl)O |
| InChIKey | PYNDSUPYXXIHRB-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate
Property Insights of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroethyl 4-fluoro-2-hydroxybutanoate. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Chloroethyl 4-fluoro-2-hydroxybutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl 4-fluoro-2-hydroxybutanoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate?
The CAS number of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate is 63905-00-0.
What is the molecular formula of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate?
The molecular formula of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate is C6H10ClFO3.
What is the molecular weight of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate?
The molecular weight of 2-Chloroethyl 4-fluoro-2-hydroxybutanoate is 184.03024 g/mol.
Where can I buy 2-Chloroethyl 4-fluoro-2-hydroxybutanoate?
You can request a quote for 2-Chloroethyl 4-fluoro-2-hydroxybutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloroethyl 4-fluoro-2-hydroxybutanoate?
Yes, CoreyChem provides custom synthesis services for 2-Chloroethyl 4-fluoro-2-hydroxybutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.