TL;DR: 3,7-Dimethyl-1,5-octadien-3,7-diol (CAS 13741-21-4) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3E)-2,6-dimethylocta-3,7-diene-2,6-diol
Also Known As: 2,6-Dimethyl-3,7-octadiene-2,6-diol, 2,6-Dimethylocta-3,7-diene-2,6-diol, Dioctylchloromethylphosphonate, (3E)-2,6-dimethylocta-3,7-diene-2,6-diol, 3,7-Octadiene-2,6-diol, 2,6-dimethyl-
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.13068 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.13068 Da |
| Heavy Atoms | 12 |
| Complexity | 182.0 |
| SMILES | CC(C)(/C=C/CC(C)(C=C)O)O |
| InChIKey | QEOHJVNDENHRCH-VOTSOKGWSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7-Dimethyl-1,5-octadien-3,7-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 3,7-Dimethyl-1,5-octadien-3,7-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dimethyl-1,5-octadien-3,7-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,7-Dimethyl-1,5-octadien-3,7-diol is 13741-21-4.
The molecular formula of 3,7-Dimethyl-1,5-octadien-3,7-diol is C10H18O2.
The molecular weight of 3,7-Dimethyl-1,5-octadien-3,7-diol is 170.13068 g/mol.
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