TL;DR: 2-Propyltetrahydrothiophene (CAS 1551-34-4) is a chemical compound with molecular formula C7H14S and molecular weight 130.08162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-propylthiolane
Also Known As: 2-propylthiolane, Thiophane, propyl-, 2-Propyltetrahydrothiophene, 2-Propyl-thiolane, Thiolane, 2-propyl
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H14S |
| Molecular Weight | 130.08162 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 130.08162 Da |
| Heavy Atoms | 8 |
| Complexity | 61.0 |
| SMILES | CCCC1CCCS1 |
| InChIKey | RKTPCTKFTDSWND-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propyltetrahydrothiophene. With a topological polar surface area (TPSA) of 25.3 Ų, 2-Propyltetrahydrothiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propyltetrahydrothiophene 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 2-Propyltetrahydrothiophene is 1551-34-4.
The molecular formula of 2-Propyltetrahydrothiophene is C7H14S.
The molecular weight of 2-Propyltetrahydrothiophene is 130.08162 g/mol.
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