TL;DR: 4-(2-Amino-2-oxoethoxy)benzoic acid (CAS 159143-14-3) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-amino-2-oxoethoxy)benzoic acid
Also Known As: 4-(2-amino-2-oxoethoxy)benzoic acid, 4-(carbamoylmethoxy)benzoic Acid, 4-(2-amino-2-oxoethoxy)benzoicacid, SP013, Benzoic acid, 4-(2-amino-2-oxoethoxy)-
| Molecular Formula | C9H9NO4 |
| Molecular Weight | 195.05316 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.05316 Da |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
| SMILES | C1=CC(=CC=C1C(=O)O)OCC(=O)N |
| InChIKey | AWIPPDRFNWTGTR-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Amino-2-oxoethoxy)benzoic acid. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Amino-2-oxoethoxy)benzoic acid. Following Lipinski's Rule of Five, 4-(2-Amino-2-oxoethoxy)benzoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2-Amino-2-oxoethoxy)benzoic acid is 159143-14-3.
The molecular formula of 4-(2-Amino-2-oxoethoxy)benzoic acid is C9H9NO4.
The molecular weight of 4-(2-Amino-2-oxoethoxy)benzoic acid is 195.05316 g/mol.
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