TL;DR: Farnesal (CAS 19317-11-4) is a chemical compound with molecular formula C15H24O and molecular weight 220.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7,11-trimethyldodeca-2,6,10-trienal
Also Known As: Farnesal, farnesone, farnesal, pract., E,E-Farnesal, farnesal, mixture of isomers
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H24O |
| Molecular Weight | 220.18271 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 220.18271 Da |
| Heavy Atoms | 16 |
| Complexity | 289.0 |
| Density | 0.890-0.900 |
| Refractive Index | 1.494-1.504 |
| Solubility | Insoluble in water; 50% soluble in heptane, triacetin |
| SMILES | CC(=CCCC(=CCCC(=CC=O)C)C)C |
| InChIKey | YHRUHBBTQZKMEX-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that Farnesal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Farnesal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Farnesal has 0 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 Farnesal is 19317-11-4.
The molecular formula of Farnesal is C15H24O.
The molecular weight of Farnesal is 220.18271 g/mol.
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