TL;DR: 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene (CAS 153817-18-6) is a chemical compound with molecular formula C9HF11 and molecular weight 317.99026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4,5-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropyl)benzene
Also Known As: 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene, 1,2,4,5-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropyl)benzene
| Molecular Formula | C9HF11 |
| Molecular Weight | 317.99026 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.99026 Da |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
| SMILES | C1=C(C(=C(C(=C1F)F)C(C(C(F)(F)F)(F)F)(F)F)F)F |
| InChIKey | RUCXHAOMVXFEPD-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene is 153817-18-6.
The molecular formula of 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene is C9HF11.
The molecular weight of 1,2,4,5-Tetrafluoro-3-(heptafluoropropyl)benzene is 317.99026 g/mol.
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