TL;DR: Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol (CAS 125349-19-1) is a chemical compound with molecular formula C12H28N2O3 and molecular weight 248.20999 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-aminoethylamino)ethanol;octanoic acid
Also Known As: Caprylic acid, aminoethylethanolamine reaction product, 2-(2-aminoethylamino)ethanol; octanoic acid, Reaction products of octanoic acid with aminoethylethanolamine, Octanoic acid, reaction products with 2-((2-aminoethyl)amino)ethanol, Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol
| Molecular Formula | C12H28N2O3 |
| Molecular Weight | 248.20999 g/mol |
| XLogP | 0.9585 |
| Topological Polar Surface Area (TPSA) | 95.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 248.20999 Da |
| Heavy Atoms | 17 |
| Complexity | 122.0 |
| SMILES | CCCCCCCC(=O)O.C(CNCCO)N |
| InChIKey | GOANEXYTWUVMDC-UHFFFAOYSA-N |
The XLogP value of 0.9585 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol. Following Lipinski's Rule of Five, Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol is 125349-19-1.
The molecular formula of Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol is C12H28N2O3.
The molecular weight of Octanoic acid, reaction products with 2-[(2-aminoethyl)amino]ethanol is 248.20999 g/mol.
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