TL;DR: 3-Nonyne, 8,8-dimethoxy- (CAS 71317-76-5) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8,8-dimethoxynon-3-yne
Also Known As: 8,8-dimethoxynon-3-yne, 3-Nonyne, 8,8-dimethoxy-, 8,8-Dimethoxy-3-nonyne, 6-Nonyn-2-one dimethyl ketal
| Molecular Formula | C11H20O2 |
| Molecular Weight | 184.14633 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 184.14633 Da |
| Heavy Atoms | 13 |
| Complexity | 181.0 |
| SMILES | CCC#CCCCC(C)(OC)OC |
| InChIKey | FOLLXEFHXQRDRH-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nonyne, 8,8-dimethoxy-. With a topological polar surface area (TPSA) of 18.5 Ų, 3-Nonyne, 8,8-dimethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Nonyne, 8,8-dimethoxy- 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 3-Nonyne, 8,8-dimethoxy- is 71317-76-5.
The molecular formula of 3-Nonyne, 8,8-dimethoxy- is C11H20O2.
The molecular weight of 3-Nonyne, 8,8-dimethoxy- is 184.14633 g/mol.
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