TL;DR: Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl- (CAS 130871-93-1) is a chemical compound with molecular formula C8H9F3 and molecular weight 162.06563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(trifluoromethyl)bicyclo[2.2.1]hept-2-ene
Also Known As: 2-trifluoromethylnorbornene, Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl-, 3-(trifluoromethyl)bicyclo[2.2.1]hept-2-ene, Bicyclo[2.2.1]hept-2-ene, 2-trifluoromethyl-, 2-(trifluoromethyl)bicyclo[2.2.1]hept-2-ene
| Molecular Formula | C8H9F3 |
| Molecular Weight | 162.06563 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.06563 Da |
| Heavy Atoms | 11 |
| Complexity | 202.0 |
| SMILES | C1CC2CC1C=C2C(F)(F)F |
| InChIKey | ZCSSLICRCYXAKF-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl-. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl- 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 Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl- is 130871-93-1.
The molecular formula of Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl- is C8H9F3.
The molecular weight of Bicyclo(2.2.1)hept-2-ene, 2-trifluoromethyl- is 162.06563 g/mol.
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