TL;DR: Benzoic acid, o-(phenylhydroxyarsino)- (CAS 100482-34-6) is a chemical compound with molecular formula C13H11AsO3 and molecular weight 289.9924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[hydroxy(phenyl)arsanyl]benzoic acid
Also Known As: 2-Carboxydiphenylarsinous acid, o-(Phenylhydroxyarsino)benzoic acid, BENZOIC ACID, o-(PHENYLHYDROXYARSINO)-, 2-[hydroxy(phenyl)arsanyl]benzoic acid
| Molecular Formula | C13H11AsO3 |
| Molecular Weight | 289.9924 g/mol |
| XLogP | 0.48 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.9924 Da |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
| SMILES | C1=CC=C(C=C1)[As](C2=CC=CC=C2C(=O)O)O |
| InChIKey | QBRSUPRMRFUFFG-UHFFFAOYSA-N |
The XLogP value of 0.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, o-(phenylhydroxyarsino)-. With a topological polar surface area (TPSA) of 57.5 Ų, Benzoic acid, o-(phenylhydroxyarsino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, o-(phenylhydroxyarsino)- has 2 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 Benzoic acid, o-(phenylhydroxyarsino)- is 100482-34-6.
The molecular formula of Benzoic acid, o-(phenylhydroxyarsino)- is C13H11AsO3.
The molecular weight of Benzoic acid, o-(phenylhydroxyarsino)- is 289.9924 g/mol.
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