TL;DR: 3-Heptafluorobutyryl-(+)-camphor (CAS 51800-99-8) is a chemical compound with molecular formula C14H15F7O2 and molecular weight 348.09604 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,4R)-3-(2,2,3,3,4,4,4-heptafluorobutanoyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Also Known As: 3-Heptafluorobutyryl-(+)-camphor, 3-(Perfluorobutyryl)-(+)-camphor, 3-(Heptafluorobutyryl)-D-camphor, 3-(Perfluorobutyryl)-D-camphor, 3-Heptafluorobutyryl-D-camphor
| Molecular Formula | C14H15F7O2 |
| Molecular Weight | 348.09604 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.09604 Da |
| Heavy Atoms | 23 |
| Complexity | 564.0 |
| SMILES | C[C@@]12CC[C@@H](C1(C)C)C(C2=O)C(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | PEWOESYEGLBLNR-XGLFCGLISA-N |
The XLogP value of 4.6 indicates that 3-Heptafluorobutyryl-(+)-camphor is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 3-Heptafluorobutyryl-(+)-camphor exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptafluorobutyryl-(+)-camphor has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Heptafluorobutyryl-(+)-camphor is 51800-99-8.
The molecular formula of 3-Heptafluorobutyryl-(+)-camphor is C14H15F7O2.
The molecular weight of 3-Heptafluorobutyryl-(+)-camphor is 348.09604 g/mol.
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