TL;DR: 2,7-Dimethyloctan-1-ol (CAS 15250-22-3) is a chemical compound with molecular formula C10H22O and molecular weight 158.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,7-dimethyloctan-1-ol
Also Known As: 2,7-dimethyloctan-1-ol, 2,7-DIMETHYL-1-OCTANOL, 1-Octanol, 2,7-dimethyl-, 2,7-Dimethyl-1-octanol #
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H22O |
| Molecular Weight | 158.16707 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.16707 Da |
| Heavy Atoms | 11 |
| Complexity | 78.0 |
| SMILES | CC(C)CCCCC(C)CO |
| InChIKey | FNLOIWOIWFHQSI-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 2,7-Dimethyloctan-1-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, 2,7-Dimethyloctan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Dimethyloctan-1-ol has 1 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 2,7-Dimethyloctan-1-ol is 15250-22-3.
The molecular formula of 2,7-Dimethyloctan-1-ol is C10H22O.
The molecular weight of 2,7-Dimethyloctan-1-ol is 158.16707 g/mol.
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