TL;DR: 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran (CAS 10160-25-5) is a chemical compound with molecular formula C12H23BrO2 and molecular weight 278.08813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(7-bromoheptoxy)oxane
Also Known As: 2-(7-bromoheptoxy)oxane, 2-(7-Bromoheptyloxy)tetrahydropyran, 2-((7-Bromoheptyl)oxy)tetrahydro-2H-pyran, 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran, 2H-Pyran, 2-[(7-bromoheptyl)oxy]tetrahydro-
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H23BrO2 |
| Molecular Weight | 278.08813 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.08813 Da |
| Heavy Atoms | 15 |
| Complexity | 142.0 |
| SMILES | C1CCOC(C1)OCCCCCCCBr |
| InChIKey | IJYBSQFJCPBQEG-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran 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 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran is 10160-25-5.
The molecular formula of 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran is C12H23BrO2.
The molecular weight of 2-[(7-Bromoheptyl)oxy]tetrahydro-2H-pyran is 278.08813 g/mol.
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