1-Methyl-3-nitropyridin-4(1H)-one
TL;DR: 1-Methyl-3-nitropyridin-4(1H)-one (CAS 64761-30-4) is a chemical compound with molecular formula C6H6N2O3 and molecular weight 154.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-nitropyridin-4-one
Also Known As: 1-Methyl-3-nitropyridin-4(1H)-one, 1-methyl-3-nitropyridin-4-one, 1-methyl-3-nitro-pyridin-4-one, 1-methyl-3-nitro-1,4-dihydropyridin-4-one, pyridine, 1,4-dihydro-1-methyl-3-nitro-4-oxo-
| Molecular Formula | C6H6N2O3 |
|---|---|
| Molecular Weight | 154.04 g/mol |
| LogP | 0.2935 |
| Topological Polar Surface Area | 65.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.03784 |
| Heavy Atoms | 11 |
| Complexity | 341.92578 |
Chemical Identifiers
| CAS Number | 64761-30-4 |
|---|---|
| SMILES | CN1C=CC(=O)C(=C1)[N+](=O)[O-] |
Product Overview
1-Methyl-3-nitropyridin-4(1H)-one (CAS 64761-30-4), with molecular formula C6H6N2O3 and molecular weight 154.04 g/mol. IUPAC: 1-methyl-3-nitropyridin-4-one.
Chemical Property Profile of 1-Methyl-3-nitropyridin-4(1H)-one
Property Insights of 1-Methyl-3-nitropyridin-4(1H)-one
The XLogP value of 0.2935 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-nitropyridin-4(1H)-one. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-3-nitropyridin-4(1H)-one. Following Lipinski's Rule of Five, 1-Methyl-3-nitropyridin-4(1H)-one has 0 hydrogen bond donor(s) and 3 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 1-Methyl-3-nitropyridin-4(1H)-one?
The CAS number of 1-Methyl-3-nitropyridin-4(1H)-one is 64761-30-4.
What is the molecular formula of 1-Methyl-3-nitropyridin-4(1H)-one?
The molecular formula of 1-Methyl-3-nitropyridin-4(1H)-one is C6H6N2O3.
What is the molecular weight of 1-Methyl-3-nitropyridin-4(1H)-one?
The molecular weight of 1-Methyl-3-nitropyridin-4(1H)-one is 154.04 g/mol.
Where can I buy 1-Methyl-3-nitropyridin-4(1H)-one?
You can request a quote for 1-Methyl-3-nitropyridin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-nitropyridin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-nitropyridin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.