TL;DR: 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- (CAS 139492-81-2) is a chemical compound with molecular formula C20H32 and molecular weight 272.2504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,5,9-trimethyl-12-prop-1-en-2-ylcyclotetradeca-1,5,9-triene
Also Known As: 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)-, 1,5,9-trimethyl-12-prop-1-en-2-ylcyclotetradeca-1,5,9-triene, 1,5,9-TRIMETHYL-12-(PROP-1-EN-2-YL)CYCLOTETRADECA-1,5,9-TRIENE
| Molecular Formula | C20H32 |
| Molecular Weight | 272.2504 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.2504 Da |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
| SMILES | CC1=CCCC(=CCC(CCC(=CCC1)C)C(=C)C)C |
| InChIKey | VWSPQDDPRITBAM-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- is 139492-81-2.
The molecular formula of 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- is C20H32.
The molecular weight of 1,5,9-Cyclotetradecatriene, 1,5,9-trimethyl-12-(1-methylethenyl)- is 272.2504 g/mol.
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