TL;DR: Acetyl nonyryl (CAS 7493-59-6) 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.
undecane-2,3-dione
Also Known As: Acetyl nonyryl, Undecane-2,3-dione, Acetyl nonanoyl, 2,3-UNDECANEDIONE, Acetyl pelargonyl
| Molecular Formula | C11H20O2 |
| Molecular Weight | 184.14633 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 184.14633 Da |
| Heavy Atoms | 13 |
| Complexity | 161.0 |
| Density | 0.905-0.915 |
| Refractive Index | 1.432-1.438 |
| Solubility | very slightly soluble in water; soluble in alcohol |
| SMILES | CCCCCCCCC(=O)C(=O)C |
| InChIKey | RMMFUALOIIVORL-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that Acetyl nonyryl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Acetyl nonyryl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetyl nonyryl 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 Acetyl nonyryl is 7493-59-6.
The molecular formula of Acetyl nonyryl is C11H20O2.
The molecular weight of Acetyl nonyryl is 184.14633 g/mol.
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