TL;DR: 4,6-Dimethylnonanoic acid (CAS 19943-71-6) is a chemical compound with molecular formula C11H22O2 and molecular weight 186.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6-dimethylnonanoic acid
Also Known As: 4,6-DIMETHYLNONANOIC ACID, 4,6-Dimethylnonanoate, 4,8-Dimethyl-nonanoate, J1.608.964H
| Molecular Formula | C11H22O2 |
| Molecular Weight | 186.16199 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 186.16199 Da |
| Heavy Atoms | 13 |
| Complexity | 143.0 |
| SMILES | CCCC(C)CC(C)CCC(=O)O |
| InChIKey | AFJVNCDRAOOULN-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 4,6-Dimethylnonanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4,6-Dimethylnonanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dimethylnonanoic acid has 1 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 4,6-Dimethylnonanoic acid is 19943-71-6.
The molecular formula of 4,6-Dimethylnonanoic acid is C11H22O2.
The molecular weight of 4,6-Dimethylnonanoic acid is 186.16199 g/mol.
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