Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate
TL;DR: Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate (CAS 156748-67-3) is a chemical compound with molecular formula C6H12F3O4P and molecular weight 236.04253 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-diethoxyphosphoryl-2,2,2-trifluoroethanol
Also Known As: Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate, 1-diethoxyphosphoryl-2,2,2-trifluoroethanol, 1-diethoxyphosphoryl-2,2,2-trifluoro-ethanol, Diethyl (2,2,2-trifluoro-1-hydroxyethyl)-phosphonate, DIETHYL (2 2 2-TRIFLUORO-1-HYDROXYETHYL&
Technical Specifications
| Molecular Formula | C6H12F3O4P |
| Molecular Weight | 236.04253 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.04253 Da |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
| SMILES | CCOP(=O)(C(C(F)(F)F)O)OCC |
| InChIKey | ZVRKPNJLSIJXPF-UHFFFAOYSA-N |
Chemical Property Profile of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate
Property Insights of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate. With a topological polar surface area (TPSA) of 55.8 Ų, Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate?
The CAS number of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate is 156748-67-3.
What is the molecular formula of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate?
The molecular formula of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate is C6H12F3O4P.
What is the molecular weight of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate?
The molecular weight of Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate is 236.04253 g/mol.
Where can I buy Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate?
You can request a quote for Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate?
Yes, CoreyChem provides custom synthesis services for Diethyl (2,2,2-trifluoro-1-hydroxyethyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.