TL;DR: 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one (CAS 1352444-96-2) is a chemical compound with molecular formula C20H13F3O and molecular weight 326.09186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
Also Known As: 1-(2-naphthyl)-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one, 1-naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
| Molecular Formula | C20H13F3O |
| Molecular Weight | 326.09186 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.09186 Da |
| Heavy Atoms | 24 |
| Complexity | 460.0 |
| SMILES | C1=CC=C2C=C(C=CC2=C1)C(=O)C=CC3=CC=C(C=C3)C(F)(F)F |
| InChIKey | XJRACTZDWAQGCJ-UHFFFAOYSA-N |
The XLogP value of 5.8 indicates that 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one is 1352444-96-2.
The molecular formula of 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one is C20H13F3O.
The molecular weight of 1-Naphthalen-2-yl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one is 326.09186 g/mol.
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