TL;DR: 2-Benzoyloxybenzoic acid (CAS 4578-66-9) is a chemical compound with molecular formula C14H10O4 and molecular weight 242.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzoyloxybenzoic acid
Also Known As: 2-(benzoyloxy)benzoic acid, 2-Benzoyloxybenzoic acid, Benzoylsalicylsaure, Benzoic acid, 2-(benzoyloxy)-, 2-phenylcarbonyloxybenzoic acid
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H10O4 |
| Molecular Weight | 242.0579 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.0579 Da |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)O |
| InChIKey | QSOVSKMNRYAVJR-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzoyloxybenzoic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzoyloxybenzoic acid. Following Lipinski's Rule of Five, 2-Benzoyloxybenzoic 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-Benzoyloxybenzoic acid is 4578-66-9.
The molecular formula of 2-Benzoyloxybenzoic acid is C14H10O4.
The molecular weight of 2-Benzoyloxybenzoic acid is 242.0579 g/mol.
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