TL;DR: (9E)-dodeca-1,9-diene (CAS 157887-66-6) is a chemical compound with molecular formula C12H22 and molecular weight 166.17215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(9E)-dodeca-1,9-diene
Also Known As: 1,9-Dodecadiene, 11-dodecadiene, E-1,9-Dodecadiene, (9E)-dodeca-1,9-diene, DODECA-1,9-DIENE
| Molecular Formula | C12H22 |
| Molecular Weight | 166.17215 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 8 |
| Exact Mass | 166.17215 Da |
| Heavy Atoms | 12 |
| Complexity | 111.0 |
| SMILES | CC/C=C/CCCCCCC=C |
| InChIKey | NXAAKAVSSNVOKK-SOFGYWHQSA-N |
The XLogP value of 5.3 indicates that (9E)-dodeca-1,9-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (9E)-dodeca-1,9-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (9E)-dodeca-1,9-diene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (9E)-dodeca-1,9-diene is 157887-66-6.
The molecular formula of (9E)-dodeca-1,9-diene is C12H22.
The molecular weight of (9E)-dodeca-1,9-diene is 166.17215 g/mol.
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