2-Hydroxy-5-nitropyridine-3-carbonitrile
TL;DR: 2-Hydroxy-5-nitropyridine-3-carbonitrile (CAS 31309-38-3) is a chemical compound with molecular formula C6H3N3O3 and molecular weight 165.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-oxo-1H-pyridine-3-carbonitrile
Also Known As: 2-Hydroxy-5-nitronicotinonitrile, 5-Nitro-2-oxo-1,2-dihydropyridine-3-carbonitrile, 2-HYDROXY-5-NITROPYRIDINE-3-CARBONITRILE, 5-nitro-2-oxo-1H-pyridine-3-carbonitrile, 3-cyano-5-nitro-2-pyridone
| Molecular Formula | C6H3N3O3 |
|---|---|
| Molecular Weight | 165.02 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 165.01744 |
| Heavy Atoms | 12 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 31309-38-3 |
|---|---|
| SMILES | C1=C(C(=O)NC=C1[N+](=O)[O-])C#N |
| InChIKey | HLQZJYLEGMYYBY-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-5-nitropyridine-3-carbonitrile (CAS 31309-38-3), with molecular formula C6H3N3O3 and molecular weight 165.02 g/mol. IUPAC: 5-nitro-2-oxo-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 2-Hydroxy-5-nitropyridine-3-carbonitrile
Property Insights of 2-Hydroxy-5-nitropyridine-3-carbonitrile
The XLogP value of -0.3 indicates that 2-Hydroxy-5-nitropyridine-3-carbonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-5-nitropyridine-3-carbonitrile. Following Lipinski's Rule of Five, 2-Hydroxy-5-nitropyridine-3-carbonitrile has 1 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 2-Hydroxy-5-nitropyridine-3-carbonitrile?
The CAS number of 2-Hydroxy-5-nitropyridine-3-carbonitrile is 31309-38-3.
What is the molecular formula of 2-Hydroxy-5-nitropyridine-3-carbonitrile?
The molecular formula of 2-Hydroxy-5-nitropyridine-3-carbonitrile is C6H3N3O3.
What is the molecular weight of 2-Hydroxy-5-nitropyridine-3-carbonitrile?
The molecular weight of 2-Hydroxy-5-nitropyridine-3-carbonitrile is 165.02 g/mol.
Where can I buy 2-Hydroxy-5-nitropyridine-3-carbonitrile?
You can request a quote for 2-Hydroxy-5-nitropyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-5-nitropyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-5-nitropyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.