TL;DR: 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine (CAS 100594-86-3) is a chemical compound with molecular formula C19H35N and molecular weight 277.27695 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hex-5-enyl-5-non-8-enylpyrrolidine
Also Known As: 2-Hex-5-enyl-5-non-8-enyl-pyrrolidine, 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine, 2-Hex-5-enyl-5-non-8-enylpyr, 2-hex-5-enyl-5-non-8-enylpyrrolidine, Pyrrolidine, 2-(5-hexenyl)-5-(8-nonenyl)-
| Molecular Formula | C19H35N |
| Molecular Weight | 277.27695 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 13 |
| Exact Mass | 277.27695 Da |
| Heavy Atoms | 20 |
| Complexity | 246.0 |
| SMILES | C=CCCCCCCCC1CCC(N1)CCCCC=C |
| InChIKey | YCQNSAJAZIVRFR-UHFFFAOYSA-N |
The XLogP value of 6.8 indicates that 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine is 100594-86-3.
The molecular formula of 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine is C19H35N.
The molecular weight of 2-(5-Hexenyl)-5-(8-nonenyl)pyrrolidine is 277.27695 g/mol.
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