TL;DR: 2-Propylthiophene (CAS 1551-27-5) is a chemical compound with molecular formula C7H10S and molecular weight 126.05032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-propylthiophene
Also Known As: 2-Propylthiophene, 2-n-Propylthiophene, Isopropylthiophene, 2-propyl-thiophene, 2-Propyl thiophene
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H10S |
| Molecular Weight | 126.05032 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.05032 Da |
| Heavy Atoms | 8 |
| Complexity | 61.0 |
| Boiling Point | 158.00 to 159.00 °C. @ 760.00 mm Hg |
| SMILES | CCCC1=CC=CS1 |
| InChIKey | BTXIJTYYMLCUHI-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-Propylthiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 2-Propylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propylthiophene 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-Propylthiophene is 1551-27-5.
The molecular formula of 2-Propylthiophene is C7H10S.
The molecular weight of 2-Propylthiophene is 126.05032 g/mol.
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