3,5-Dinitro-4-hydroxypyridine N-oxide
TL;DR: 3,5-Dinitro-4-hydroxypyridine N-oxide (CAS 3213-95-4) is a chemical compound with molecular formula C5H3N3O6 and molecular weight 201.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-3,5-dinitropyridin-4-one
Also Known As: 3,5-DINITRO-4-HYDROXYPYRIDINE N-OXIDE, 1-hydroxy-3,5-dinitropyridin-4-one, 1-hydroxy-3,5-dinitropyridin-4(1h)-one, 3,5-Dinitro-4-hydroxypyridin-N-oxid, 4-Pyridinol,3,5-dinitro-, 1-oxide
| Molecular Formula | C5H3N3O6 |
|---|---|
| Molecular Weight | 201.00 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.00218 |
| Heavy Atoms | 14 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 3213-95-4 |
|---|---|
| SMILES | C1=C(C(=O)C(=CN1O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | YCLPBCRIRBKPHZ-UHFFFAOYSA-N |
Product Overview
3,5-Dinitro-4-hydroxypyridine N-oxide (CAS 3213-95-4), with molecular formula C5H3N3O6 and molecular weight 201.00 g/mol. IUPAC: 1-hydroxy-3,5-dinitropyridin-4-one.
Chemical Property Profile of 3,5-Dinitro-4-hydroxypyridine N-oxide
Property Insights of 3,5-Dinitro-4-hydroxypyridine N-oxide
The XLogP value of -0.1 indicates that 3,5-Dinitro-4-hydroxypyridine N-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dinitro-4-hydroxypyridine N-oxide. Following Lipinski's Rule of Five, 3,5-Dinitro-4-hydroxypyridine N-oxide has 1 hydrogen bond donor(s) and 7 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 3,5-Dinitro-4-hydroxypyridine N-oxide?
The CAS number of 3,5-Dinitro-4-hydroxypyridine N-oxide is 3213-95-4.
What is the molecular formula of 3,5-Dinitro-4-hydroxypyridine N-oxide?
The molecular formula of 3,5-Dinitro-4-hydroxypyridine N-oxide is C5H3N3O6.
What is the molecular weight of 3,5-Dinitro-4-hydroxypyridine N-oxide?
The molecular weight of 3,5-Dinitro-4-hydroxypyridine N-oxide is 201.00 g/mol.
Where can I buy 3,5-Dinitro-4-hydroxypyridine N-oxide?
You can request a quote for 3,5-Dinitro-4-hydroxypyridine N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dinitro-4-hydroxypyridine N-oxide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dinitro-4-hydroxypyridine N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.