Methyl 2-hydroxy-5-nitronicotinate
TL;DR: Methyl 2-hydroxy-5-nitronicotinate (CAS 1000578-10-8) is a chemical compound with molecular formula C7H6N2O5 and molecular weight 198.02766 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-nitro-2-oxo-1H-pyridine-3-carboxylate
Also Known As: Methyl 2-hydroxy-5-nitronicotinate, methyl 5-nitro-2-oxo-1,2-dihydropyridine-3-carboxylate, methylhydroxynitronicotinate, 3-Methoxycarbonyl-5-nitro-2(1H)-pyridinone, methyl 5-nitro-2-oxo-1H-pyridine-3-carboxylate
Technical Specifications
| Molecular Formula | C7H6N2O5 |
| Molecular Weight | 198.02766 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.02766 Da |
| Heavy Atoms | 14 |
| Complexity | 363.0 |
| SMILES | COC(=O)C1=CC(=CNC1=O)[N+](=O)[O-] |
| InChIKey | DLMMETCUQGSGOK-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-hydroxy-5-nitronicotinate
Property Insights of Methyl 2-hydroxy-5-nitronicotinate
The XLogP value of -0.2 indicates that Methyl 2-hydroxy-5-nitronicotinate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-hydroxy-5-nitronicotinate. Following Lipinski's Rule of Five, Methyl 2-hydroxy-5-nitronicotinate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 2-hydroxy-5-nitronicotinate?
The CAS number of Methyl 2-hydroxy-5-nitronicotinate is 1000578-10-8.
What is the molecular formula of Methyl 2-hydroxy-5-nitronicotinate?
The molecular formula of Methyl 2-hydroxy-5-nitronicotinate is C7H6N2O5.
What is the molecular weight of Methyl 2-hydroxy-5-nitronicotinate?
The molecular weight of Methyl 2-hydroxy-5-nitronicotinate is 198.02766 g/mol.
Where can I buy Methyl 2-hydroxy-5-nitronicotinate?
You can request a quote for Methyl 2-hydroxy-5-nitronicotinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-hydroxy-5-nitronicotinate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-hydroxy-5-nitronicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.