TL;DR: Tris(4-trifluoromethylphenyl)phosphine (CAS 13406-29-6) is a chemical compound with molecular formula C21H12F9P and molecular weight 466.05328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tris[4-(trifluoromethyl)phenyl]phosphane
Also Known As: Tris(4-trifluoromethylphenyl)phosphine, Tris(4-(trifluoromethyl)phenyl)phosphine, tris[4-(trifluoromethyl)phenyl]phosphane, Tris(p-trifluoromethylphenyl)phosphine, Tris[4-(trifluoromethyl)phenyl]phosphine
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H12F9P |
| Molecular Weight | 466.05328 g/mol |
| XLogP | 7.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 466.05328 Da |
| Heavy Atoms | 31 |
| Complexity | 478.0 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)P(C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F |
| InChIKey | PXYCJKZSCDFXLR-UHFFFAOYSA-N |
The XLogP value of 7.3 indicates that Tris(4-trifluoromethylphenyl)phosphine 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(4-trifluoromethylphenyl)phosphine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(4-trifluoromethylphenyl)phosphine has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tris(4-trifluoromethylphenyl)phosphine is 13406-29-6.
The molecular formula of Tris(4-trifluoromethylphenyl)phosphine is C21H12F9P.
The molecular weight of Tris(4-trifluoromethylphenyl)phosphine is 466.05328 g/mol.
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