TL;DR: Thiophene, 2-isopentyl- (CAS 26963-33-7) is a chemical compound with molecular formula C9H14S and molecular weight 154.08162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-methylbutyl)thiophene
Also Known As: Thiophene, 2-isopentyl-, 2-Isopentylthiophene, 2-(3-methylbutyl)thiophene, 2-isopentyl-thiophene, 2-Isopentylthiophene #
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H14S |
| Molecular Weight | 154.08162 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.08162 Da |
| Heavy Atoms | 10 |
| Complexity | 88.0 |
| SMILES | CC(C)CCC1=CC=CS1 |
| InChIKey | CXZOHVNUTXOENP-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that Thiophene, 2-isopentyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Thiophene, 2-isopentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene, 2-isopentyl- 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 Thiophene, 2-isopentyl- is 26963-33-7.
The molecular formula of Thiophene, 2-isopentyl- is C9H14S.
The molecular weight of Thiophene, 2-isopentyl- is 154.08162 g/mol.
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