TL;DR: 3-(2-aminoethoxy)benzoic Acid (CAS 1051369-32-4) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-aminoethoxy)benzoic acid
Also Known As: 3-(2-aminoethoxy)benzoic Acid, 3-(2-Aminoethoxy)benzoic acid hydrochloride, benzoic acid, 3-(2-aminoethoxy)-, hydrochloride, G50671
| Molecular Formula | C9H11NO3 |
| Molecular Weight | 181.0739 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.0739 Da |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
| SMILES | C1=CC(=CC(=C1)OCCN)C(=O)O |
| InChIKey | WLBCCLZJSPBNMU-UHFFFAOYSA-N |
The XLogP value of -0.6 indicates that 3-(2-aminoethoxy)benzoic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-aminoethoxy)benzoic Acid. Following Lipinski's Rule of Five, 3-(2-aminoethoxy)benzoic Acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(2-aminoethoxy)benzoic Acid is 1051369-32-4.
The molecular formula of 3-(2-aminoethoxy)benzoic Acid is C9H11NO3.
The molecular weight of 3-(2-aminoethoxy)benzoic Acid is 181.0739 g/mol.
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