TL;DR: 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran (CAS 1005106-83-1) is a chemical compound with molecular formula C17H24O and molecular weight 244.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-methylpropyl)-2-phenyl-3-prop-1-en-2-yloxolane
Also Known As: 5-(2-methylpropyl)-2-phenyl-3-prop-1-en-2-yloxolane, 5-isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran, 5-(2-methylpropyl)-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran
| Molecular Formula | C17H24O |
| Molecular Weight | 244.18271 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.18271 Da |
| Heavy Atoms | 18 |
| Complexity | 275.0 |
| SMILES | CC(C)CC1CC(C(O1)C2=CC=CC=C2)C(=C)C |
| InChIKey | NVMGRFPZTHTFKJ-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran 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 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran is 1005106-83-1.
The molecular formula of 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran is C17H24O.
The molecular weight of 5-Isobutyl-2-phenyl-3-(prop-1-en-2-yl)tetrahydrofuran is 244.18271 g/mol.
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