2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine
TL;DR: 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine (CAS 6281-75-0) is a chemical compound with molecular formula C9H9N3O4 and molecular weight 223.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(methoxymethyl)-6-methyl-5-nitro-2-oxo-1H-pyridine-3-carbonitrile
Also Known As: Nitropyridone, 2-HYDROXY-4-METHOXYMETHYL-6-METHYLNICOTINONITRILE, 2-hydroxy-4-(methoxymethyl)-6-methyl-5-nitropyridine-3-carbonitrile, 4-(methoxymethyl)-6-methyl-5-nitro-2-oxo-1H-pyridine-3-carbonitrile, 4-(Methoxymethyl)-6-methyl-5-nitro-2-oxo-1,2-dihydropyridine-3-carbonitrile
| Molecular Formula | C9H9N3O4 |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.05931 |
| Heavy Atoms | 16 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 6281-75-0 |
|---|---|
| SMILES | CC1=C(C(=C(C(=O)N1)C#N)COC)[N+](=O)[O-] |
| InChIKey | FDZPYSHPLURJEA-UHFFFAOYSA-N |
Product Overview
2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine (CAS 6281-75-0), with molecular formula C9H9N3O4 and molecular weight 223.06 g/mol. IUPAC: 4-(methoxymethyl)-6-methyl-5-nitro-2-oxo-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine
Property Insights of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine
The XLogP value of -0.7 indicates that 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine. Following Lipinski's Rule of Five, 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine 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
Frequently Asked Questions
What is the CAS number of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine?
The CAS number of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine is 6281-75-0.
What is the molecular formula of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine?
The molecular formula of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine is C9H9N3O4.
What is the molecular weight of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine?
The molecular weight of 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine is 223.06 g/mol.
Where can I buy 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine?
You can request a quote for 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-nitro-4-methoxymethyl-5-cyano-6-oxypyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.