1,3-dihydroxypyridin-2(1H)-one
TL;DR: 1,3-dihydroxypyridin-2(1H)-one (CAS 129999-94-6) is a chemical compound with molecular formula C5H5NO3 and molecular weight 127.02694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dihydroxypyridin-2-one
Also Known As: 1,3-dihydroxypyridin-2(1H)-one, 1,3-dihydroxypyridin-2-one, 2,3-Dihydroxypyridinium-1-olate, 2(1H)-pyridinone, 1,3-dihydroxy-, 1,3-dihydroxy-1,2-dihydropyridin-2-one
Technical Specifications
| Molecular Formula | C5H5NO3 |
| Molecular Weight | 127.02694 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.02694 Da |
| Heavy Atoms | 9 |
| Complexity | 194.0 |
| SMILES | C1=CN(C(=O)C(=C1)O)O |
| InChIKey | RFSIMZHQROYDFQ-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-dihydroxypyridin-2(1H)-one
Property Insights of 1,3-dihydroxypyridin-2(1H)-one
The XLogP value of -0.2 indicates that 1,3-dihydroxypyridin-2(1H)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dihydroxypyridin-2(1H)-one. Following Lipinski's Rule of Five, 1,3-dihydroxypyridin-2(1H)-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-dihydroxypyridin-2(1H)-one?
The CAS number of 1,3-dihydroxypyridin-2(1H)-one is 129999-94-6.
What is the molecular formula of 1,3-dihydroxypyridin-2(1H)-one?
The molecular formula of 1,3-dihydroxypyridin-2(1H)-one is C5H5NO3.
What is the molecular weight of 1,3-dihydroxypyridin-2(1H)-one?
The molecular weight of 1,3-dihydroxypyridin-2(1H)-one is 127.02694 g/mol.
Where can I buy 1,3-dihydroxypyridin-2(1H)-one?
You can request a quote for 1,3-dihydroxypyridin-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-dihydroxypyridin-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 1,3-dihydroxypyridin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.