methyl 4-methoxy-1-oxido-pyridine-3-carboxylate
TL;DR: methyl 4-methoxy-1-oxido-pyridine-3-carboxylate (CAS 40899-41-0) is a chemical compound with molecular formula C8H9NO4 and molecular weight 183.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-methoxy-1-oxidopyridin-1-ium-3-carboxylate
Also Known As: methyl 4-methoxy-1-oxido-pyridine-3-carboxylate, methyl 4-methoxy-1-oxidopyridin-1-ium-3-carboxylate, 4-methoxy-1-oxy-nicotinic acid methyl ester, methyl 4-methoxy-3-pyridinecarboxylate-1-oxide, Methyl 4-methoxy-1-oxo-1lambda~5~-pyridine-3-carboxylate
| Molecular Formula | C8H9NO4 |
|---|---|
| Molecular Weight | 183.05 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.05316 |
| Heavy Atoms | 13 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 40899-41-0 |
|---|---|
| SMILES | COC1=C(C=[N+](C=C1)[O-])C(=O)OC |
| InChIKey | RGSKCQUFHPAMIE-UHFFFAOYSA-N |
Product Overview
methyl 4-methoxy-1-oxido-pyridine-3-carboxylate (CAS 40899-41-0), with molecular formula C8H9NO4 and molecular weight 183.05 g/mol. IUPAC: methyl 4-methoxy-1-oxidopyridin-1-ium-3-carboxylate.
Chemical Property Profile of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate
Property Insights of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate
The XLogP value of -0.3 indicates that methyl 4-methoxy-1-oxido-pyridine-3-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-methoxy-1-oxido-pyridine-3-carboxylate. Following Lipinski's Rule of Five, methyl 4-methoxy-1-oxido-pyridine-3-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate?
The CAS number of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate is 40899-41-0.
What is the molecular formula of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate?
The molecular formula of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate is C8H9NO4.
What is the molecular weight of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate?
The molecular weight of methyl 4-methoxy-1-oxido-pyridine-3-carboxylate is 183.05 g/mol.
Where can I buy methyl 4-methoxy-1-oxido-pyridine-3-carboxylate?
You can request a quote for methyl 4-methoxy-1-oxido-pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-methoxy-1-oxido-pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-methoxy-1-oxido-pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.