TL;DR: Isolongifolene epoxide (CAS 67999-56-8) is a chemical compound with molecular formula C15H24O and molecular weight 220.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,8,8-tetramethyl-6-oxatetracyclo[7.2.1.01,7.05,7]dodecane
Also Known As: Isolongifolene oxide, Isolongifolene epoxide, 4a,7-Methano-4aH-naphth[1,8a-b]oxirene, octahydro-4,4,8,8-tetramethyl-, 2,2,8,8-tetramethyl-6-oxatetracyclo[7.2.1.01,7.05,7]dodecane, 2,2,7,7-Tetramethyl-5,6-epoxytricyclo-(6.2.1.0(1,6))undecane
| Molecular Formula | C15H24O |
| Molecular Weight | 220.18271 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.18271 Da |
| Heavy Atoms | 16 |
| Complexity | 370.0 |
| SMILES | CC1(CCC2C3(C14CCC(C4)C3(C)C)O2)C |
| InChIKey | VQHLGZRKOZIABH-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that Isolongifolene epoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Isolongifolene epoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isolongifolene epoxide 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 Isolongifolene epoxide is 67999-56-8.
The molecular formula of Isolongifolene epoxide is C15H24O.
The molecular weight of Isolongifolene epoxide is 220.18271 g/mol.
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