TL;DR: 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- (CAS 132156-55-9) is a chemical compound with molecular formula C18H30O and molecular weight 262.22968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-tert-butyl-4,4,5-trimethyl-3-oxatetracyclo[6.3.1.02,6.05,10]dodecane
Also Known As: 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl-
| Molecular Formula | C18H30O |
| Molecular Weight | 262.22968 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 262.22968 Da |
| Heavy Atoms | 19 |
| Complexity | 431.0 |
| SMILES | CC1(C2(C3CC4CC(C3)C(C2C4)(O1)C(C)(C)C)C)C |
| InChIKey | CYMWZZACFUOBTC-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- 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 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- is 132156-55-9.
The molecular formula of 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- is C18H30O.
The molecular weight of 8-Oxatetracyclo[5.2.1.1(2,6).1(4,10)]dodecane, 7-tert-butyl-1,9,9-trimethyl- is 262.22968 g/mol.
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