TL;DR: 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- (CAS 13832-89-8) is a chemical compound with molecular formula C15H22O and molecular weight 218.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7,11-trimethyldodeca-2,4,6,10-tetraenal
Also Known As: 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl-, 3,7,11-trimethyl-2,4,6,10-dodecatetraen-1-al, 2,4,6,10-Dodecatetraenal,3,7,11-trimethyl, 3,7,11-TRIMETHYLDODECA-2,4,6,10-TETRAENAL, 3,7,11-trimethyl-2,4,6,10-dodecatetraene-1-al
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H22O |
| Molecular Weight | 218.16707 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.16707 Da |
| Heavy Atoms | 16 |
| Complexity | 323.0 |
| SMILES | CC(=CCCC(=CC=CC(=CC=O)C)C)C |
| InChIKey | XXDVGEYVTWJVBB-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- 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 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- is 13832-89-8.
The molecular formula of 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- is C15H22O.
The molecular weight of 2,4,6,10-Dodecatetraenal, 3,7,11-trimethyl- is 218.16707 g/mol.
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