TL;DR: 3-Pentyltetrahydro-2h-pyran-2-one (CAS 32821-72-0) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-pentyloxan-2-one
Also Known As: 3-pentyloxan-2-one, 3-pentyltetrahydro-2h-pyran-2-one, Tetrahydro-3-pentyl-2H-pyran-2-one, 3-pentyl-tetrahydro-pyran-2-one, xi-Tetrahydro-3-pentyl-2H-pyran-2-one
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.13068 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.13068 Da |
| Heavy Atoms | 12 |
| Complexity | 143.0 |
| SMILES | CCCCCC1CCCOC1=O |
| InChIKey | GYSLAGLXKCQGLV-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 3-Pentyltetrahydro-2h-pyran-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Pentyltetrahydro-2h-pyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pentyltetrahydro-2h-pyran-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Pentyltetrahydro-2h-pyran-2-one is 32821-72-0.
The molecular formula of 3-Pentyltetrahydro-2h-pyran-2-one is C10H18O2.
The molecular weight of 3-Pentyltetrahydro-2h-pyran-2-one is 170.13068 g/mol.
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