TL;DR: (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate (CAS 134051-89-1) is a chemical compound with molecular formula C16H20F13N2O4P and molecular weight 582.09534 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[morpholin-4-yl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)phosphoryl]morpholine
Also Known As: (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate, 2-(perfluorohexyl)ethyl dimorpholinophosphinate, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl di-4-morpholinylphosphinate, Phosphinic acid, di-4-morpholinyl-, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester, 4-[morpholin-4-yl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)phosphoryl]morpholine
| Molecular Formula | C16H20F13N2O4P |
| Molecular Weight | 582.09534 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 10 |
| Exact Mass | 582.09534 Da |
| Heavy Atoms | 36 |
| Complexity | 777.0 |
| SMILES | C1COCCN1P(=O)(N2CCOCC2)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | MYWNYBRHKQPGRM-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate has 0 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate is 134051-89-1.
The molecular formula of (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate is C16H20F13N2O4P.
The molecular weight of (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate is 582.09534 g/mol.
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