TL;DR: 3-Hydroxy-2,3-diphenylbutanoic acid (CAS 113341-60-9) is a chemical compound with molecular formula C16H16O3 and molecular weight 256.10995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-2,3-diphenylbutanoic acid
Also Known As: 3-hydroxy-2,3-diphenylbutanoic acid, 2,3-Diphenyl-3-hydroxybuttersaeure, 3-Hydroxy-2, (mixture of isomers), Benzenepropanoicacid, b-hydroxy-b-methyl-a-phenyl-, AP-951/40919297
| Molecular Formula | C16H16O3 |
| Molecular Weight | 256.10995 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.10995 Da |
| Heavy Atoms | 19 |
| Complexity | 303.0 |
| SMILES | CC(C1=CC=CC=C1)(C(C2=CC=CC=C2)C(=O)O)O |
| InChIKey | ZSLKTMPTAWDXOT-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2,3-diphenylbutanoic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 3-Hydroxy-2,3-diphenylbutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-2,3-diphenylbutanoic acid 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 3-Hydroxy-2,3-diphenylbutanoic acid is 113341-60-9.
The molecular formula of 3-Hydroxy-2,3-diphenylbutanoic acid is C16H16O3.
The molecular weight of 3-Hydroxy-2,3-diphenylbutanoic acid is 256.10995 g/mol.
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