4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid
TL;DR: 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid (CAS 126727-55-7) is a chemical compound with molecular formula C7H7NO3 and molecular weight 153.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-1-oxidopyridin-1-ium-3-carboxylic acid
Also Known As: 4-methyl-1-oxidopyridin-1-ium-3-carboxylic acid, 3-Pyridinecarboxylicacid, 4-methyl-, 1-oxide, 3-Pyridinecarboxylicacid,4-methyl-,1-oxide, 3-Pyridinecarboxylicacid,4-methyl-,1-oxide(9CI), 4-methyl-1-oxido-pyridine-3-carboxylic Acid
Technical Specifications
| Molecular Formula | C7H7NO3 |
| Molecular Weight | 153.04259 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 153.04259 Da |
| Heavy Atoms | 11 |
| Complexity | 160.0 |
| SMILES | CC1=C(C=[N+](C=C1)[O-])C(=O)O |
| InChIKey | SMQYLNRRXBBILH-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid
Property Insights of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid
The XLogP value of -0.3 indicates that 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid. Following Lipinski's Rule of Five, 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid has 1 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 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid?
The CAS number of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid is 126727-55-7.
What is the molecular formula of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid?
The molecular formula of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid is C7H7NO3.
What is the molecular weight of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid?
The molecular weight of 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid is 153.04259 g/mol.
Where can I buy 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid?
You can request a quote for 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-1-oxidopyridin-1-ium-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.