TL;DR: 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] (CAS 65294-20-4) is a chemical compound with molecular formula C19H18F6 and molecular weight 360.13126 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,2-dimethylbenzene
Also Known As: 2,2-Bis(3,4-dimethylphenyl)hexafluoropropane, 4,4'-(Perfluoropropane-2,2-diyl)bis(1,2-dimethylbenzene), 2,2-bis hexafluoropropane, 4-(Trifluoromethoxy)anisole, 2,2-Bis(3,4-dixylyl)hexafluoro propane
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H18F6 |
| Molecular Weight | 360.13126 g/mol |
| XLogP | 7.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.13126 Da |
| Heavy Atoms | 25 |
| Complexity | 410.0 |
| SMILES | CC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)C)C)(C(F)(F)F)C(F)(F)F)C |
| InChIKey | GLFKFHJEFMLTOB-UHFFFAOYSA-N |
The XLogP value of 7.3 indicates that 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] is 65294-20-4.
The molecular formula of 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] is C19H18F6.
The molecular weight of 1,1'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[3,4-dimethylbenzene] is 360.13126 g/mol.
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