3-Methoxy-6-methyl-4-nitropyridazine 1-oxide
TL;DR: 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide (CAS 4683-87-8) is a chemical compound with molecular formula C6H7N3O4 and molecular weight 185.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-6-methyl-4-nitro-1-oxidopyridazin-1-ium
Also Known As: NCIOpen2_000140, 3-methoxy-6-methyl-4-nitropyridazine 1-oxide, 3-methoxy-6-methyl-4-nitro-1-oxidopyridazin-1-ium, 3-methoxy-6-methyl-4-nitropyridazin-1-ol, 3-methoxy-6-methyl-4-nitropyridazin-1-ium-1-olate
| Molecular Formula | C6H7N3O4 |
|---|---|
| Molecular Weight | 185.04 g/mol |
| LogP | -0.05978 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.04366 |
| Heavy Atoms | 13 |
| Complexity | 351.97775 |
Chemical Identifiers
| CAS Number | 4683-87-8 |
|---|---|
| SMILES | CC1=CC(=C(N=[N+]1[O-])OC)[N+](=O)[O-] |
Product Overview
3-Methoxy-6-methyl-4-nitropyridazine 1-oxide (CAS 4683-87-8), with molecular formula C6H7N3O4 and molecular weight 185.04 g/mol. IUPAC: 3-methoxy-6-methyl-4-nitro-1-oxidopyridazin-1-ium.
Chemical Property Profile of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide
Property Insights of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide
The XLogP value of -0.05978 indicates that 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide. Following Lipinski's Rule of Five, 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide has 0 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 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide?
The CAS number of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide is 4683-87-8.
What is the molecular formula of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide?
The molecular formula of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide is C6H7N3O4.
What is the molecular weight of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide?
The molecular weight of 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide is 185.04 g/mol.
Where can I buy 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide?
You can request a quote for 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-6-methyl-4-nitropyridazine 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.