TL;DR: 2-Hept-6-enyl-3-penta-2,4-diynyloxirane (CAS 122122-03-6) is a chemical compound with molecular formula C14H18O and molecular weight 202.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hept-6-enyl-3-penta-2,4-diynyloxirane
Also Known As: Panaxyne epoxide, Panaquinquecol 5, 2-hept-6-enyl-3-penta-2,4-diynyloxirane, PQ 5, 2-hept-6-enyl-3-penta-2,4-diynyl-oxirane
| Molecular Formula | C14H18O |
| Molecular Weight | 202.13577 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 202.13577 Da |
| Heavy Atoms | 15 |
| Complexity | 306.0 |
| SMILES | C=CCCCCCC1C(O1)CC#CC#C |
| InChIKey | TVKDYKYMRUCXKP-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 2-Hept-6-enyl-3-penta-2,4-diynyloxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 2-Hept-6-enyl-3-penta-2,4-diynyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hept-6-enyl-3-penta-2,4-diynyloxirane 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 2-Hept-6-enyl-3-penta-2,4-diynyloxirane is 122122-03-6.
The molecular formula of 2-Hept-6-enyl-3-penta-2,4-diynyloxirane is C14H18O.
The molecular weight of 2-Hept-6-enyl-3-penta-2,4-diynyloxirane is 202.13577 g/mol.
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