TL;DR: 2-(dodecanoylamino)butanoic Acid (CAS 152697-44-4) is a chemical compound with molecular formula C16H31NO3 and molecular weight 285.2304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dodecanoylamino)butanoic acid
Also Known As: 2-(dodecanoylamino)butanoic Acid, 2-dodecanamidobutanoic acid, 2-dodecanamidobutanoicacid
| Molecular Formula | C16H31NO3 |
| Molecular Weight | 285.2304 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 285.2304 Da |
| Heavy Atoms | 20 |
| Complexity | 266.0 |
| SMILES | CCCCCCCCCCCC(=O)NC(CC)C(=O)O |
| InChIKey | RSLJJRNCGLGZLT-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that 2-(dodecanoylamino)butanoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(dodecanoylamino)butanoic Acid. Following Lipinski's Rule of Five, 2-(dodecanoylamino)butanoic Acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(dodecanoylamino)butanoic Acid is 152697-44-4.
The molecular formula of 2-(dodecanoylamino)butanoic Acid is C16H31NO3.
The molecular weight of 2-(dodecanoylamino)butanoic Acid is 285.2304 g/mol.
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