TL;DR: 9-Octylheptadecan-9-ol (CAS 17687-72-8) is a chemical compound with molecular formula C25H52O and molecular weight 368.40182 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-octylheptadecan-9-ol
Also Known As: 9-octylheptadecan-9-ol, (trioctylmethanol), 9-Octylheptadecane-9-ol, tri-n-octylcarbinol, 9-OCTYL-9-HEPTADECANOL
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C25H52O |
| Molecular Weight | 368.40182 g/mol |
| XLogP | 11.3 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 21 |
| Exact Mass | 368.40182 Da |
| Heavy Atoms | 26 |
| Complexity | 220.0 |
| SMILES | CCCCCCCCC(CCCCCCCC)(CCCCCCCC)O |
| InChIKey | GIJUBRUJCGBQEM-UHFFFAOYSA-N |
The XLogP value of 11.3 indicates that 9-Octylheptadecan-9-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 9-Octylheptadecan-9-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Octylheptadecan-9-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 9-Octylheptadecan-9-ol is 17687-72-8.
The molecular formula of 9-Octylheptadecan-9-ol is C25H52O.
The molecular weight of 9-Octylheptadecan-9-ol is 368.40182 g/mol.
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