TL;DR: 1-Methyltetraline (CAS 1559-81-5) is a chemical compound with molecular formula C11H14 and molecular weight 146.10954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-1,2,3,4-tetrahydronaphthalene
Also Known As: 1-METHYLTETRALINE, METHYLTETRALIN, Methyltetralin [Czech], 1-METHYLTETRALIN, 1-Methyl-1,2,3,4-tetrahydronaphthalene
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H14 |
| Molecular Weight | 146.10954 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.10954 Da |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
| SMILES | CC1CCCC2=CC=CC=C12 |
| InChIKey | APBBTKKLSNPFDP-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 1-Methyltetraline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Methyltetraline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyltetraline has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Methyltetraline is 1559-81-5.
The molecular formula of 1-Methyltetraline is C11H14.
The molecular weight of 1-Methyltetraline is 146.10954 g/mol.
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