TL;DR: 2,4-Nonadien-1-ol (CAS 62488-56-6) is a chemical compound with molecular formula C9H16O and molecular weight 140.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nona-2,4-dien-1-ol
Also Known As: 2,4-Nonadien-1-ol, nona-2,4-dien-1-ol, 2,4-Nonadien-1-ol,(2E,4E)-, 263-571-7, EINECS 263-571-7
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H16O |
| Molecular Weight | 140.12012 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 140.12012 Da |
| Heavy Atoms | 10 |
| Complexity | 103.0 |
| Density | 0.862-0.872 |
| Refractive Index | 1.486-1.496 |
| Solubility | Insoluble in water; soluble in fat |
| SMILES | CCCCC=CC=CCO |
| InChIKey | NCPWFIVLKCFWSP-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Nonadien-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 2,4-Nonadien-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Nonadien-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 2,4-Nonadien-1-ol is 62488-56-6.
The molecular formula of 2,4-Nonadien-1-ol is C9H16O.
The molecular weight of 2,4-Nonadien-1-ol is 140.12012 g/mol.
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