TL;DR: Dehydrolinalool, (S)- (CAS 125411-11-2) is a chemical compound with molecular formula C10H16O and molecular weight 152.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3,7-dimethyloct-6-en-1-yn-3-ol
Also Known As: Dehydrolinalool, (S)-, Dehydrolinalool, (-)-, Fluorosulfuric acid-d, (3S)-3,7-Dimethyl-6-octen-1-yn-3-ol, (S)-3,7-Dimethyloct-6-en-1-yn-3-ol
| Molecular Formula | C10H16O |
| Molecular Weight | 152.12012 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 152.12012 Da |
| Heavy Atoms | 11 |
| Complexity | 190.0 |
| SMILES | CC(=CCC[C@@](C)(C#C)O)C |
| InChIKey | YWTIDNZYLFTNQQ-SNVBAGLBSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dehydrolinalool, (S)-. With a topological polar surface area (TPSA) of 20.2 Ų, Dehydrolinalool, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dehydrolinalool, (S)- 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 Dehydrolinalool, (S)- is 125411-11-2.
The molecular formula of Dehydrolinalool, (S)- is C10H16O.
The molecular weight of Dehydrolinalool, (S)- is 152.12012 g/mol.
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