TL;DR: 2-(2-Oxo-benzooxazol-3-yl)-propionic acid (CAS 1212166-37-4) is a chemical compound with molecular formula C10H9NO4 and molecular weight 207.05316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-oxo-1,3-benzoxazol-3-yl)propanoic acid
Also Known As: 2-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanoic acid, 2-(2-Oxo-benzooxazol-3-yl)-propionic acid, 2-(2-oxo-1,3-benzoxazol-3-yl)propanoic acid, 3953AD, BAS 10150047
| Molecular Formula | C10H9NO4 |
| Molecular Weight | 207.05316 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.05316 Da |
| Heavy Atoms | 15 |
| Complexity | 291.0 |
| SMILES | CC(C(=O)O)N1C2=CC=CC=C2OC1=O |
| InChIKey | UUBVLNODMJCOTD-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Oxo-benzooxazol-3-yl)-propionic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Oxo-benzooxazol-3-yl)-propionic acid. Following Lipinski's Rule of Five, 2-(2-Oxo-benzooxazol-3-yl)-propionic acid has 1 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 2-(2-Oxo-benzooxazol-3-yl)-propionic acid is 1212166-37-4.
The molecular formula of 2-(2-Oxo-benzooxazol-3-yl)-propionic acid is C10H9NO4.
The molecular weight of 2-(2-Oxo-benzooxazol-3-yl)-propionic acid is 207.05316 g/mol.
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