TL;DR: Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium (CAS 11077-59-1) is a chemical compound with molecular formula C15H15Pr and molecular weight 336.02505 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tris(cyclopenta-1,3-diene);praseodymium(3+)
Also Known As: TRIS(CYCLOPENTADIENYL)PRASEODYMIUM, cyclopenta-1,3-diene;praseodymium(3+), Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium, Praseodymium, tris(eta5-2,4-cyclopentadien-1-yl)-, TRIS(CYCLOPENTADIENYL)PRASEODYMIUM: (REO)
| Molecular Formula | C15H15Pr |
| Molecular Weight | 336.02505 g/mol |
| XLogP | 4.22 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 336.02505 Da |
| Heavy Atoms | 16 |
| Complexity | 86.0 |
| SMILES | [CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Pr+3] |
| InChIKey | CTHYOYODNXUAHW-UHFFFAOYSA-N |
The XLogP value of 4.22 indicates that Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium is 11077-59-1.
The molecular formula of Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium is C15H15Pr.
The molecular weight of Tris(eta5-2,4-cyclopentadien-1-yl)praseodymium is 336.02505 g/mol.
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