TL;DR: Methoxycyclooctane (CAS 13213-32-6) is a chemical compound with molecular formula C9H18O and molecular weight 142.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methoxycyclooctane
Also Known As: Methoxycyclooctane, Cyclooctane, methoxy-, Ether, cyclooctyl methyl, Cyclooctyl-methyl-aether, Cyclooctyl methyl ether #
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H18O |
| Molecular Weight | 142.13577 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.13577 Da |
| Heavy Atoms | 10 |
| Complexity | 72.0 |
| SMILES | COC1CCCCCCC1 |
| InChIKey | FEBQZXLIAIUGGQ-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Methoxycyclooctane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Methoxycyclooctane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methoxycyclooctane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methoxycyclooctane is 13213-32-6.
The molecular formula of Methoxycyclooctane is C9H18O.
The molecular weight of Methoxycyclooctane is 142.13577 g/mol.
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