TL;DR: 11-(Perfluorobutyl)undecanoic acid (CAS 1652-66-0) is a chemical compound with molecular formula C15H21F9O2 and molecular weight 404.13977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
12,12,13,13,14,14,15,15,15-nonafluoropentadecanoic acid
Also Known As: 11-(perfluorobutyl)undecanoic acid, 11-(Nonafluorobutyl)undecanoic acid, C4F9(CH2)10CO2H, 12,12,13,13,14,14,15,15,15-nonafluoropentadecanoic Acid, Pentadecanoic acid, 12,12,13,13,14,14,15,15,15-nonafluoro-
| Molecular Formula | C15H21F9O2 |
| Molecular Weight | 404.13977 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 404.13977 Da |
| Heavy Atoms | 26 |
| Complexity | 433.0 |
| SMILES | C(CCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CCCCC(=O)O |
| InChIKey | AAXRUIWADFCFQA-UHFFFAOYSA-N |
The XLogP value of 7.2 indicates that 11-(Perfluorobutyl)undecanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 11-(Perfluorobutyl)undecanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-(Perfluorobutyl)undecanoic acid has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 11-(Perfluorobutyl)undecanoic acid is 1652-66-0.
The molecular formula of 11-(Perfluorobutyl)undecanoic acid is C15H21F9O2.
The molecular weight of 11-(Perfluorobutyl)undecanoic acid is 404.13977 g/mol.
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