TL;DR: 5-Methylbicyclo[2.2.2]oct-2-ene (CAS 14926-88-6) is a chemical compound with molecular formula C9H14 and molecular weight 122.10955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methylbicyclo[2.2.2]oct-2-ene
Also Known As: 5-methylbicyclo[2.2.2]oct-2-ene, 7-methylbicyclo[2.2.2]oct-2-ene, 5-methylbicyclo[2.2.2]-2-octene, C9-H14, 5-Methylbicyclo[2.2.2]octane-2-ene
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H14 |
| Molecular Weight | 122.10955 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 122.10955 Da |
| Heavy Atoms | 9 |
| Complexity | 135.0 |
| SMILES | CC1CC2CCC1C=C2 |
| InChIKey | XOGBWGJGWDPLQZ-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 5-Methylbicyclo[2.2.2]oct-2-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5-Methylbicyclo[2.2.2]oct-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methylbicyclo[2.2.2]oct-2-ene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-Methylbicyclo[2.2.2]oct-2-ene is 14926-88-6.
The molecular formula of 5-Methylbicyclo[2.2.2]oct-2-ene is C9H14.
The molecular weight of 5-Methylbicyclo[2.2.2]oct-2-ene is 122.10955 g/mol.
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