TL;DR: 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane (CAS 137720-42-4) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,5,7,7-tetramethyl-6,8-dioxabicyclo[3.2.1]octane
Also Known As: Dopamine D4 receptor, 1,5,7,7-tetramethyl-6,8-dioxabicyclo[3.2.1]octane, 6,8-Dioxabicyclo(3.2.1)octane, 1,5,7,7-tetramethyl-
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.13068 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.13068 Da |
| Heavy Atoms | 12 |
| Complexity | 212.0 |
| SMILES | CC1(C2(CCCC(O1)(O2)C)C)C |
| InChIKey | PUFFWQKDMLTJJY-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane. With a topological polar surface area (TPSA) of 18.5 Ų, 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane 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 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane is 137720-42-4.
The molecular formula of 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane is C10H18O2.
The molecular weight of 1,5,7,7-Tetramethyl-6,8-dioxabicyclo[3.2.1]octane is 170.13068 g/mol.
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