TL;DR: 5-Hexadecyne, 16,16-diethoxy- (CAS 71393-93-6) is a chemical compound with molecular formula C20H38O2 and molecular weight 310.28717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
16,16-diethoxyhexadec-5-yne
Also Known As: 16,16-diethoxyhexadec-5-yne, 11-Hexadecynal diethyl acetal, 5-Hexadecyne, 16,16-diethoxy-, 16,16-Diethoxy-5-hexadecyne
| Molecular Formula | C20H38O2 |
| Molecular Weight | 310.28717 g/mol |
| XLogP | 7.4 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 310.28717 Da |
| Heavy Atoms | 22 |
| Complexity | 268.0 |
| SMILES | CCCCC#CCCCCCCCCCC(OCC)OCC |
| InChIKey | HNZDZJYRSDSKMW-UHFFFAOYSA-N |
The XLogP value of 7.4 indicates that 5-Hexadecyne, 16,16-diethoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 5-Hexadecyne, 16,16-diethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hexadecyne, 16,16-diethoxy- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 5-Hexadecyne, 16,16-diethoxy- is 71393-93-6.
The molecular formula of 5-Hexadecyne, 16,16-diethoxy- is C20H38O2.
The molecular weight of 5-Hexadecyne, 16,16-diethoxy- is 310.28717 g/mol.
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