TL;DR: 2-(Pentafluorophenoxy)ethanamine (CAS 110225-28-0) is a chemical compound with molecular formula C8H6F5NO and molecular weight 227.03696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,3,4,5,6-pentafluorophenoxy)ethanamine
Also Known As: 2-(pentafluorophenoxy)ethanamine, 2-(Perfluorophenoxy)ethanamine, 2-(Perfluorophenoxy)ethan-1-amine, 2-(2,3,4,5,6-pentafluorophenoxy)ethanamine, 2-pentafluorophenoxyethan-1-amine
| Molecular Formula | C8H6F5NO |
| Molecular Weight | 227.03696 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.03696 Da |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
| SMILES | C(COC1=C(C(=C(C(=C1F)F)F)F)F)N |
| InChIKey | NLGUSCKEXHHEEJ-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Pentafluorophenoxy)ethanamine. With a topological polar surface area (TPSA) of 35.3 Ų, 2-(Pentafluorophenoxy)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Pentafluorophenoxy)ethanamine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Pentafluorophenoxy)ethanamine is 110225-28-0.
The molecular formula of 2-(Pentafluorophenoxy)ethanamine is C8H6F5NO.
The molecular weight of 2-(Pentafluorophenoxy)ethanamine is 227.03696 g/mol.
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