TL;DR: (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic acid (CAS 107755-97-5) is a chemical compound with molecular formula C8H7NO3 and molecular weight 165.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(6-oxo-1H-pyridin-3-yl)prop-2-enoic acid
Also Known As: (2E)-3-(6-oxo-1H-pyridin-3-yl)prop-2-enoic acid, 2-Propenoic acid, 3-(1,6-dihydro-6-oxo-3-pyridinyl)-, (2E)-3-(6-HYDROXYPYRIDIN-3-YL)PROP-2-ENOIC ACID
| Molecular Formula | C8H7NO3 |
| Molecular Weight | 165.04259 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.04259 Da |
| Heavy Atoms | 12 |
| Complexity | 299.0 |
| SMILES | C1=CC(=O)NC=C1C=CC(=O)O |
| InChIKey | GPGCFLDKCNSBSH-UHFFFAOYSA-N |
The XLogP value of -0.3 indicates that (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic acid. Following Lipinski's Rule of Five, (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic 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 (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic acid is 107755-97-5.
The molecular formula of (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic acid is C8H7NO3.
The molecular weight of (2E)-3-(6-Hydroxypyridin-3-YL)prop-2-enoic acid is 165.04259 g/mol.
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