3-Nitropyridin-1-ium-4-amine
TL;DR: 3-Nitropyridin-1-ium-4-amine (CAS 1681-37-4) is a chemical compound with molecular formula C5H6N3O2+ and molecular weight 140.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitropyridin-1-ium-4-amine
Also Known As: 4-Amino-3-nitropyridine, 3-nitropyridin-1-ium-4-amine
| Molecular Formula | C5H6N3O2+ |
|---|---|
| Molecular Weight | 140.05 g/mol |
| LogP | -0.0089 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.046 |
| Heavy Atoms | 10 |
| Complexity | 260.82492 |
Chemical Identifiers
| CAS Number | 1681-37-4 |
|---|---|
| SMILES | C1=C[NH+]=CC(=C1N)[N+](=O)[O-] |
Product Overview
3-Nitropyridin-1-ium-4-amine (CAS 1681-37-4), with molecular formula C5H6N3O2+ and molecular weight 140.05 g/mol. IUPAC: 3-nitropyridin-1-ium-4-amine.
Chemical Property Profile of 3-Nitropyridin-1-ium-4-amine
Property Insights of 3-Nitropyridin-1-ium-4-amine
The XLogP value of -0.0089 indicates that 3-Nitropyridin-1-ium-4-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitropyridin-1-ium-4-amine. Following Lipinski's Rule of Five, 3-Nitropyridin-1-ium-4-amine has 1 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 3-Nitropyridin-1-ium-4-amine?
The CAS number of 3-Nitropyridin-1-ium-4-amine is 1681-37-4.
What is the molecular formula of 3-Nitropyridin-1-ium-4-amine?
The molecular formula of 3-Nitropyridin-1-ium-4-amine is C5H6N3O2+.
What is the molecular weight of 3-Nitropyridin-1-ium-4-amine?
The molecular weight of 3-Nitropyridin-1-ium-4-amine is 140.05 g/mol.
Where can I buy 3-Nitropyridin-1-ium-4-amine?
You can request a quote for 3-Nitropyridin-1-ium-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitropyridin-1-ium-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitropyridin-1-ium-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.